0 B5R0.2 BrC/C=C/CBr MCULE-9004545331 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.2 BrCC#CCBr MCULE-3414204664 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.2 BrCC=CCBr MCULE-4240565660 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.2 BrCCCCBr MCULE-5088378536 [0,0,0,0,0,0|3,0,0]=3 4 B5R0.2 C#CCC#CC MCULE-1607912981 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.2 C#CCCCBr MCULE-3834416844 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.2 C#CCCCC MCULE-5706969297 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.2 C#CCCCCl MCULE-3879115419 [0,0,0,0,0,0|2,0,2]=4 8 B5R0.2 C#CCCCI MCULE-4063232871 [0,0,0,0,0,0|2,0,2]=4 9 B5R0.2 C#CCCCN MCULE-3191305523 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.2 C#CCCCN MCULE-3259677872 [0,0,0,0,0,0|2,0,2]=4 11 B5R0.2 C#CCCCO MCULE-6360852809 [0,0,0,0,0,0|1,0,2]=3 12 B5R0.2 C#CCCNC MCULE-1590490287 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.2 C#CCCNC MCULE-4004733974 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.2 C#CCCNC MCULE-7566671614 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.2 C#CCCOC MCULE-7152168835 [0,0,0,0,0,0|3,0,1]=4 16 B5R0.2 C#CCNCC MCULE-1258696824 [0,0,0,0,0,0|2,0,1]=3 17 B5R0.2 C#CCNCC MCULE-3363103527 [0,0,0,0,0,0|2,0,1]=3 18 B5R0.2 C#CCNOC MCULE-3336529831 [0,0,0,0,0,0|3,0,1]=4 19 B5R0.2 C#CCNOC MCULE-7807129420 [0,0,0,0,0,0|3,0,1]=4 20 B5R0.2 C#CCOCC MCULE-1055202735 [0,0,0,0,0,0|1,0,1]=2 21 B5R0.2 C#CCOCCl MCULE-6198656758 [0,0,0,0,0,0|2,0,1]=3 22 B5R0.2 C#CCSCC MCULE-5718021970 [0,0,0,0,0,0|1,1,1]=3 23 B5R0.2 C(=CCCl)CN MCULE-8092426171 [0,0,0,0,0,0|3,0,1]=4 24 B5R0.2 C(=CCCl)CN MCULE-9706120646 [0,0,0,0,0,0|3,0,1]=4 25 B5R0.2 C(=C\CCl)\CN MCULE-3474871402 [0,0,0,0,0,0|3,0,1]=4 26 B5R0.2 C/C=C/CC#N MCULE-3707973146 [0,0,0,0,0,0|2,0,2]=4 27 B5R0.2 C/C=C/CCC MCULE-9851656818 [0,0,0,0,0,0|2,0,1]=3 28 B5R0.2 C/C=C/CCO MCULE-3952855392 [0,0,0,0,0,0|1,0,1]=2 29 B5R0.2 C/C=C/OCC MCULE-2891896400 [0,0,0,0,0,0|1,0,2]=3 30 B5R0.2 C/C=C\CCC MCULE-1013657748 [0,0,0,0,0,0|2,0,1]=3 31 B5R0.2 C=C/C=C/CC MCULE-5996202716 [0,0,0,0,0,0|2,0,2]=4 32 B5R0.2 C=C=CCCBr MCULE-5561919067 [0,0,0,0,0,0|2,0,2]=4 33 B5R0.2 C=C=CCCI MCULE-7583015374 [0,0,0,0,0,0|2,0,2]=4 34 B5R0.2 C=C=CCCN MCULE-5814175873 [0,0,0,0,0,0|2,0,2]=4 35 B5R0.2 C=C=CCCN MCULE-8177198091 [0,0,0,0,0,0|2,0,2]=4 36 B5R0.2 C=C=CCCO MCULE-1054355649 [0,0,0,0,0,0|1,0,2]=3 37 B5R0.2 C=CC#CCO MCULE-5199716906 [0,0,0,0,0,0|1,0,3]=4 38 B5R0.2 C=CC/C=C/C MCULE-8732875285 [0,0,0,0,0,0|2,0,2]=4 39 B5R0.2 C=CCC=CC MCULE-8643449832 [0,0,0,0,0,0|2,0,2]=4 40 B5R0.2 C=CCCCBr MCULE-5027518679 [0,0,0,0,0,0|2,0,2]=4 41 B5R0.2 C=CCCCC MCULE-4750698031 [0,0,0,0,0,0|2,0,1]=3 42 B5R0.2 C=CCCCCl MCULE-3877430809 [0,0,0,0,0,0|2,0,2]=4 43 B5R0.2 C=CCCCI MCULE-8692831514 [0,0,0,0,0,0|2,0,2]=4 44 B5R0.2 C=CCCCN MCULE-5787926547 [0,0,0,0,0,0|2,0,2]=4 45 B5R0.2 C=CCCCN MCULE-7346989227 [0,0,0,0,0,0|2,0,2]=4 46 B5R0.2 C=CCCCO MCULE-5946342321 [0,0,0,0,0,0|1,0,2]=3 47 B5R0.2 C=CCCNC MCULE-2124263362 [0,0,0,0,0,0|3,0,1]=4 48 B5R0.2 C=CCCNC MCULE-5024925990 [0,0,0,0,0,0|3,0,1]=4 49 B5R0.2 C=CCCOC MCULE-4681354270 [0,0,0,0,0,0|3,0,1]=4 50 B5R0.2 C=CCNCC MCULE-6987567673 [0,0,0,0,0,0|2,0,1]=3 51 B5R0.2 C=CCNCC MCULE-8318544337 [0,0,0,0,0,0|2,0,1]=3 52 B5R0.2 C=CCOC=C MCULE-7085070702 [0,0,0,0,0,0|1,0,3]=4 53 B5R0.2 C=CCOC=O MCULE-4161785970 [0,0,0,0,0,0|2,0,2]=4 54 B5R0.2 C=CCOCC MCULE-4363356618 [0,0,0,0,0,0|1,0,1]=2 55 B5R0.2 C=CCOCCl MCULE-6656252526 [0,0,0,0,0,0|2,0,1]=3 56 B5R0.2 C=CCONC MCULE-4537899476 [0,0,0,0,0,0|2,0,1]=3 57 B5R0.2 C=CCONC MCULE-9645204142 [0,0,0,0,0,0|2,0,1]=3 58 B5R0.2 C=CCSCC MCULE-3816911529 [0,0,0,0,0,0|1,1,1]=3 59 B5R0.2 C=CCSSC MCULE-8417830164 [0,0,0,0,0,0|2,1,1]=4 60 B5R0.2 C=COCCC MCULE-4423853666 [0,0,0,0,0,0|1,0,2]=3 61 B5R0.2 C=COCCCl MCULE-7782311030 [0,0,0,0,0,0|1,0,2]=3 62 B5R0.2 C=COCCN MCULE-8052872924 [0,0,0,0,0,0|1,0,2]=3 63 B5R0.2 C=COCCN MCULE-8496820259 [0,0,0,0,0,0|1,0,2]=3 64 B5R0.2 C=COCCO MCULE-9383372818 [0,0,0,0,0,0|0,0,2]=2 65 B5R0.2 CC#CCC=O MCULE-6071390808 [0,0,0,0,0,0|1,0,3]=4 66 B5R0.2 CC#CCCBr MCULE-5650557113 [0,0,0,0,0,0|2,0,1]=3 67 B5R0.2 CC#CCCC MCULE-8179328151 [0,0,0,0,0,0|2,0,1]=3 68 B5R0.2 CC#CCCN MCULE-2130545109 [0,0,0,0,0,0|2,0,1]=3 69 B5R0.2 CC#CCCN MCULE-7156357315 [0,0,0,0,0,0|2,0,1]=3 70 B5R0.2 CC#CCCO MCULE-9400138491 [0,0,0,0,0,0|1,0,1]=2 71 B5R0.2 CC#CCNC MCULE-3549759323 [0,0,0,0,0,0|3,0,1]=4 72 B5R0.2 CC#CCNC MCULE-7250319597 [0,0,0,0,0,0|3,0,1]=4 73 B5R0.2 CC#CCON MCULE-6251915377 [0,0,0,0,0,0|3,0,1]=4 74 B5R0.2 CC#CCON MCULE-7089104173 [0,0,0,0,0,0|3,0,1]=4 75 B5R0.2 CC/C=C/C=O MCULE-5102906061 [0,0,0,0,0,0|1,0,3]=4 76 B5R0.2 CC/C=C/CC MCULE-6762040186 [0,0,0,0,0,0|2,0,1]=3 77 B5R0.2 CC/C=C\C#N MCULE-2648641382 [0,0,0,0,0,0|2,0,2]=4 78 B5R0.2 CC/C=C\CC MCULE-9418110460 [0,0,0,0,0,0|2,0,1]=3 79 B5R0.2 CC/C=C\CO MCULE-5480473249 [0,0,0,0,0,0|1,0,1]=2 80 B5R0.2 CC=CCC#N MCULE-6960681395 [0,0,0,0,0,0|2,0,2]=4 81 B5R0.2 CC=CCCBr MCULE-7329159278 [0,0,0,0,0,0|2,0,1]=3 82 B5R0.2 CC=CCCC MCULE-8736231124 [0,0,0,0,0,0|2,0,1]=3 83 B5R0.2 CC=CCCN MCULE-5129102475 [0,0,0,0,0,0|2,0,1]=3 84 B5R0.2 CC=CCCN MCULE-8500001929 [0,0,0,0,0,0|2,0,1]=3 85 B5R0.2 CC=CCCO MCULE-4302367089 [0,0,0,0,0,0|1,0,1]=2 86 B5R0.2 CC=COCC MCULE-1473170404 [0,0,0,0,0,0|1,0,2]=3 87 B5R0.2 CCC#CC=O MCULE-3889262436 [0,0,0,0,0,0|1,0,3]=4 88 B5R0.2 CCC#CCBr MCULE-4725992084 [0,0,0,0,0,0|2,0,1]=3 89 B5R0.2 CCC#CCC MCULE-2027962178 [0,0,0,0,0,0|2,0,1]=3 90 B5R0.2 CCC#CCCl MCULE-7122423261 [0,0,0,0,0,0|2,0,1]=3 91 B5R0.2 CCC#CCN MCULE-8712641266 [0,0,0,0,0,0|2,0,1]=3 92 B5R0.2 CCC#CCO MCULE-8633965917 [0,0,0,0,0,0|1,0,1]=2 93 B5R0.2 CCC=CC#N MCULE-1091834842 [0,0,0,0,0,0|2,0,2]=4 94 B5R0.2 CCC=CC=O MCULE-1318250395 [0,0,0,0,0,0|1,0,3]=4 95 B5R0.2 CCC=CCBr MCULE-5326763881 [0,0,0,0,0,0|2,0,1]=3 96 B5R0.2 CCC=CCC MCULE-5435957422 [0,0,0,0,0,0|2,0,1]=3 97 B5R0.2 CCC=CCO MCULE-5633399984 [0,0,0,0,0,0|1,0,1]=2 98 B5R0.2 CCCC#CI MCULE-5016901652 [0,0,0,0,0,0|2,0,2]=4 99 B5R0.2 CCCC=NO MCULE-7364375780 [0,0,0,0,0,0|2,0,1]=3 100 B5R0.2 CCCCC#N MCULE-4015236167 [0,0,0,0,0,0|2,0,1]=3 101 B5R0.2 CCCCC=O MCULE-4736782822 [0,0,0,0,0,0|1,0,2]=3 102 B5R0.2 CCCCCBr MCULE-8513521912 [0,0,0,0,0,0|2,0,0]=2 103 B5R0.2 CCCCCC MCULE-3465692202 [0,0,0,0,0,0|2,0,0]=2 104 B5R0.2 CCCCCCl MCULE-4412759460 [0,0,0,0,0,0|2,0,0]=2 105 B5R0.2 CCCCCF MCULE-6399883281 [0,0,0,0,0,0|2,0,0]=2 106 B5R0.2 CCCCCI MCULE-4590300793 [0,0,0,0,0,0|2,0,0]=2 107 B5R0.2 CCCCCN MCULE-3371742982 [0,0,0,0,0,0|2,0,0]=2 108 B5R0.2 CCCCCN MCULE-4371067300 [0,0,0,0,0,0|2,0,0]=2 109 B5R0.2 CCCCCN MCULE-6547961798 [0,0,0,0,0,0|2,0,0]=2 110 B5R0.2 CCCCCN MCULE-7483248760 [0,0,0,0,0,0|2,0,0]=2 111 B5R0.2 CCCCCO MCULE-8714292632 [0,0,0,0,0,0|1,0,0]=1 112 B5R0.2 CCCCCS MCULE-5476379340 [0,0,0,0,0,0|1,1,0]=2 113 B5R0.2 CCCCNC MCULE-9321610906 [0,0,0,0,0,0|3,0,0]=3 114 B5R0.2 CCCCNN MCULE-6681305566 [0,0,0,0,0,0|3,0,0]=3 115 B5R0.2 CCCCNN MCULE-6890760890 [0,0,0,0,0,0|3,0,0]=3 116 B5R0.2 CCCCNN MCULE-7362497327 [0,0,0,0,0,0|3,0,0]=3 117 B5R0.2 CCCCNN MCULE-8463623644 [0,0,0,0,0,0|3,0,0]=3 118 B5R0.2 CCCCNO MCULE-1911206569 [0,0,0,0,0,0|2,0,0]=2 119 B5R0.2 CCCCNO MCULE-3820646216 [0,0,0,0,0,0|2,0,0]=2 120 B5R0.2 CCCCOC MCULE-9814272675 [0,0,0,0,0,0|3,0,0]=3 121 B5R0.2 CCCCON MCULE-7582349983 [0,0,0,0,0,0|3,0,0]=3 122 B5R0.2 CCCCON MCULE-8175627798 [0,0,0,0,0,0|3,0,0]=3 123 B5R0.2 CCCCSC MCULE-2799775567 [0,0,0,0,0,0|3,0,0]=3 124 B5R0.2 CCCN=C=O MCULE-9014468293 [0,0,0,0,0,0|2,0,2]=4 125 B5R0.2 CCCN=C=S MCULE-7947940355 [0,0,0,0,0,0|2,1,1]=4 126 B5R0.2 CCCNC=O MCULE-6344556391 [0,0,0,0,0,0|2,0,2]=4 127 B5R0.2 CCCNCC MCULE-7948828264 [0,0,0,0,0,0|2,0,0]=2 128 B5R0.2 CCCNCC MCULE-9107549207 [0,0,0,0,0,0|2,0,0]=2 129 B5R0.2 CCCOC=O MCULE-3133604529 [0,0,0,0,0,0|2,0,1]=3 130 B5R0.2 CCCOCBr MCULE-3585683043 [0,0,0,0,0,0|2,0,0]=2 131 B5R0.2 CCCOCC MCULE-9971916790 [0,0,0,0,0,0|1,0,0]=1 132 B5R0.2 CCCOCCl MCULE-1932627202 [0,0,0,0,0,0|2,0,0]=2 133 B5R0.2 CCCSC#N MCULE-9018157774 [0,0,0,0,0,0|2,1,1]=4 134 B5R0.2 CCCSCC MCULE-4547385568 [0,0,0,0,0,0|1,1,0]=2 135 B5R0.2 CCCSSC MCULE-3127072032 [0,0,0,0,0,0|2,1,0]=3 136 B5R0.2 CCNCC#N MCULE-8279629720 [0,0,0,0,0,0|2,0,1]=3 137 B5R0.2 CCNCCCl MCULE-2589770119 [0,0,0,0,0,0|2,0,0]=2 138 B5R0.2 CCNCCCl MCULE-3098032672 [0,0,0,0,0,0|2,0,0]=2 139 B5R0.2 CCNCCN MCULE-7854769899 [0,0,0,0,0,0|2,0,0]=2 140 B5R0.2 CCNCCO MCULE-2537734730 [0,0,0,0,0,0|1,0,0]=1 141 B5R0.2 CCNCCO MCULE-3738714907 [0,0,0,0,0,0|1,0,0]=1 142 B5R0.2 CCNNCC MCULE-4789314801 [0,0,0,0,0,0|3,0,0]=3 143 B5R0.2 CCNNCC MCULE-9060220585 [0,0,0,0,0,0|3,0,0]=3 144 B5R0.2 CCO/C=C\Br MCULE-7396084973 [0,0,0,0,0,0|1,0,2]=3 145 B5R0.2 CCOC=CBr MCULE-5241125671 [0,0,0,0,0,0|1,0,2]=3 146 B5R0.2 CCOCC#N MCULE-6709940440 [0,0,0,0,0,0|1,0,1]=2 147 B5R0.2 CCOCCBr MCULE-4818900555 [0,0,0,0,0,0|1,0,0]=1 148 B5R0.2 CCOCCCl MCULE-1290576729 [0,0,0,0,0,0|1,0,0]=1 149 B5R0.2 CCOCCI MCULE-1833092968 [0,0,0,0,0,0|1,0,0]=1 150 B5R0.2 CCOCCN MCULE-1254431240 [0,0,0,0,0,0|1,0,0]=1 151 B5R0.2 CCOCCN MCULE-4039110889 [0,0,0,0,0,0|1,0,0]=1 152 B5R0.2 CCOCCN MCULE-4400456933 [0,0,0,0,0,0|1,0,0]=1 153 B5R0.2 CCOCCO MCULE-4311513289 [0,0,0,0,0,0|0,0,0]=0 154 B5R0.2 CCOCCS MCULE-3968740645 [0,0,0,0,0,0|0,1,0]=1 155 B5R0.2 CCSCC#N MCULE-4093791055 [0,0,0,0,0,0|1,1,1]=3 156 B5R0.2 CCSCC=O MCULE-8069035019 [0,0,0,0,0,0|0,1,2]=3 157 B5R0.2 CCSCCBr MCULE-9449933342 [0,0,0,0,0,0|1,1,0]=2 158 B5R0.2 CCSCCCl MCULE-4057847237 [0,0,0,0,0,0|1,1,0]=2 159 B5R0.2 CCSCCN MCULE-3375644872 [0,0,0,0,0,0|1,1,0]=2 160 B5R0.2 CCSCCN MCULE-4466279976 [0,0,0,0,0,0|1,1,0]=2 161 B5R0.2 CCSCCO MCULE-3557086162 [0,0,0,0,0,0|0,1,0]=1 162 B5R0.2 CCSCCS MCULE-4583054157 [0,0,0,0,0,0|0,2,0]=2 163 B5R0.2 CCSSCC MCULE-7989926475 [0,0,0,0,0,0|2,1,0]=3 164 B5R0.2 CC[Se][Se]CC MCULE-2725282576 [0,0,0,0,0,0|2,1,0]=3 165 B5R0.2 CNCCC#N MCULE-6686234290 [0,0,0,0,0,0|3,0,1]=4 166 B5R0.2 CNCCCBr MCULE-3376600253 [0,0,0,0,0,0|3,0,0]=3 167 B5R0.2 CNCCCBr MCULE-6212326106 [0,0,0,0,0,0|3,0,0]=3 168 B5R0.2 CNCCCCl MCULE-1007719210 [0,0,0,0,0,0|3,0,0]=3 169 B5R0.2 CNCCCCl MCULE-6146901643 [0,0,0,0,0,0|3,0,0]=3 170 B5R0.2 CNCCCF MCULE-7647417887 [0,0,0,0,0,0|3,0,0]=3 171 B5R0.2 CNCCCN MCULE-1736081896 [0,0,0,0,0,0|3,0,0]=3 172 B5R0.2 CNCCCO MCULE-9530478547 [0,0,0,0,0,0|2,0,0]=2 173 B5R0.2 CNCCNC MCULE-1378979868 [0,0,0,0,0,0|4,0,0]=4 174 B5R0.2 CNCCNC MCULE-3281508478 [0,0,0,0,0,0|4,0,0]=4 175 B5R0.2 CNCCOC MCULE-2857904484 [0,0,0,0,0,0|4,0,0]=4 176 B5R0.2 CNCCOC MCULE-5342712496 [0,0,0,0,0,0|4,0,0]=4 177 B5R0.2 CNCCSC MCULE-2812984399 [0,0,0,0,0,0|4,0,0]=4 178 B5R0.2 CNCCSC MCULE-2942435951 [0,0,0,0,0,0|4,0,0]=4 179 B5R0.2 CNOCCN MCULE-3163962093 [0,0,0,0,0,0|2,0,0]=2 180 B5R0.2 CNOCCN MCULE-7379538500 [0,0,0,0,0,0|2,0,0]=2 181 B5R0.2 COCCC#N MCULE-3009737584 [0,0,0,0,0,0|3,0,1]=4 182 B5R0.2 COCCC=O MCULE-2812117208 [0,0,0,0,0,0|2,0,2]=4 183 B5R0.2 COCCCBr MCULE-6489536401 [0,0,0,0,0,0|3,0,0]=3 184 B5R0.2 COCCCCl MCULE-9192274624 [0,0,0,0,0,0|3,0,0]=3 185 B5R0.2 COCCCF MCULE-5055725246 [0,0,0,0,0,0|3,0,0]=3 186 B5R0.2 COCCCI MCULE-9111605439 [0,0,0,0,0,0|3,0,0]=3 187 B5R0.2 COCCCN MCULE-1421362990 [0,0,0,0,0,0|3,0,0]=3 188 B5R0.2 COCCCN MCULE-4783132205 [0,0,0,0,0,0|3,0,0]=3 189 B5R0.2 COCCCO MCULE-4041418048 [0,0,0,0,0,0|2,0,0]=2 190 B5R0.2 COCCCS MCULE-2371333731 [0,0,0,0,0,0|2,1,0]=3 191 B5R0.2 COCCNN MCULE-2086510453 [0,0,0,0,0,0|4,0,0]=4 192 B5R0.2 COCCNN MCULE-4830987822 [0,0,0,0,0,0|4,0,0]=4 193 B5R0.2 COCCNN MCULE-8361975855 [0,0,0,0,0,0|4,0,0]=4 194 B5R0.2 COCCOC MCULE-7572196731 [0,0,0,0,0,0|4,0,0]=4 195 B5R0.2 COCCON MCULE-3507489398 [0,0,0,0,0,0|4,0,0]=4 196 B5R0.2 COCCON MCULE-8506879697 [0,0,0,0,0,0|4,0,0]=4 197 B5R0.2 COCCSC MCULE-5362054021 [0,0,0,0,0,0|4,0,0]=4 198 B5R0.2 CONCCN MCULE-3332727097 [0,0,0,0,0,0|3,0,0]=3 199 B5R0.2 CONCCN MCULE-5066538639 [0,0,0,0,0,0|3,0,0]=3 200 B5R0.2 CONCCO MCULE-9787830121 [0,0,0,0,0,0|2,0,0]=2 201 B5R0.2 CSCCC#N MCULE-5755086116 [0,0,0,0,0,0|3,0,1]=4 202 B5R0.2 CSCCC=O MCULE-6273241704 [0,0,0,0,0,0|2,0,2]=4 203 B5R0.2 CSCCCBr MCULE-8399851816 [0,0,0,0,0,0|3,0,0]=3 204 B5R0.2 CSCCCCl MCULE-1829120476 [0,0,0,0,0,0|3,0,0]=3 205 B5R0.2 CSCCCN MCULE-1030938424 [0,0,0,0,0,0|3,0,0]=3 206 B5R0.2 CSCCCN MCULE-4664984921 [0,0,0,0,0,0|3,0,0]=3 207 B5R0.2 CSCCCO MCULE-9232413185 [0,0,0,0,0,0|2,0,0]=2 208 B5R0.2 CSCCCS MCULE-8405766359 [0,0,0,0,0,0|2,1,0]=3 209 B5R0.2 CSCCON MCULE-9125601960 [0,0,0,0,0,0|4,0,0]=4 210 B5R0.2 CSSCCN MCULE-7065189564 [0,0,0,0,0,0|2,1,0]=3 211 B5R0.2 CSSCCN MCULE-8654200268 [0,0,0,0,0,0|2,1,0]=3 212 B5R0.2 ClC/C=C/CCl MCULE-3586653669 [0,0,0,0,0,0|3,0,1]=4 213 B5R0.2 ClC/C=C\CCl MCULE-9193094097 [0,0,0,0,0,0|3,0,1]=4 214 B5R0.2 ClCC#CCCl MCULE-6432554678 [0,0,0,0,0,0|3,0,1]=4 215 B5R0.2 ClCC=CCCl MCULE-9190878082 [0,0,0,0,0,0|3,0,1]=4 216 B5R0.2 ClCCCCBr MCULE-7973194927 [0,0,0,0,0,0|3,0,0]=3 217 B5R0.2 ClCCCCCl MCULE-4863501782 [0,0,0,0,0,0|3,0,0]=3 218 B5R0.2 ClCCCCI MCULE-4303507089 [0,0,0,0,0,0|3,0,0]=3 219 B5R0.2 ClCCOCCl MCULE-7585684590 [0,0,0,0,0,0|2,0,0]=2 220 B5R0.2 ClCOCCBr MCULE-6843473950 [0,0,0,0,0,0|2,0,0]=2 221 B5R0.2 FCCCCBr MCULE-8408956872 [0,0,0,0,0,0|3,0,0]=3 222 B5R0.2 FCCCCF MCULE-1347438150 [0,0,0,0,0,0|3,0,0]=3 223 B5R0.2 FCCN=C=S MCULE-4106769677 [0,0,0,0,0,0|3,0,1]=4 224 B5R0.2 ICCCCI MCULE-1390457250 [0,0,0,0,0,0|3,0,0]=3 225 B5R0.2 N#CCCCBr MCULE-2664469446 [0,0,0,0,0,0|3,0,1]=4 226 B5R0.2 N#CCCCCl MCULE-3310172135 [0,0,0,0,0,0|3,0,1]=4 227 B5R0.2 N#CCCCF MCULE-3514322336 [0,0,0,0,0,0|3,0,1]=4 228 B5R0.2 N#CCCCI MCULE-7661529037 [0,0,0,0,0,0|3,0,1]=4 229 B5R0.2 N#CCCCN MCULE-7159177087 [0,0,0,0,0,0|3,0,1]=4 230 B5R0.2 N#CCCCN MCULE-8406710235 [0,0,0,0,0,0|3,0,1]=4 231 B5R0.2 N#CCCCO MCULE-2108386837 [0,0,0,0,0,0|2,0,1]=3 232 B5R0.2 N#CCOC=O MCULE-4453241991 [0,0,0,0,0,0|2,0,2]=4 233 B5R0.2 N#CSCCCl MCULE-1181766006 [0,0,0,0,0,0|2,1,1]=4 234 B5R0.2 N#N=NCCBr MCULE-5285576727 [0,0,0,0,0,0|4,0,0]=4 235 B5R0.2 N#N=NCCCl MCULE-2902338750 [0,0,0,0,0,0|4,0,0]=4 236 B5R0.2 N#N=NCCF MCULE-8153375666 [0,0,0,0,0,0|4,0,0]=4 237 B5R0.2 N#N=NCCI MCULE-6126000950 [0,0,0,0,0,0|4,0,0]=4 238 B5R0.2 N#N=NCCN MCULE-2129393630 [0,0,0,0,0,0|4,0,0]=4 239 B5R0.2 N#N=NCCN MCULE-2260153271 [0,0,0,0,0,0|4,0,0]=4 240 B5R0.2 N#N=NCCO MCULE-6147827656 [0,0,0,0,0,0|3,0,0]=3 241 B5R0.2 NC/C=C/CN MCULE-3194321905 [0,0,0,0,0,0|3,0,1]=4 242 B5R0.2 NC/C=C/CN MCULE-8357316852 [0,0,0,0,0,0|3,0,1]=4 243 B5R0.2 NC/C=C\CCl MCULE-7895966955 [0,0,0,0,0,0|3,0,1]=4 244 B5R0.2 NC/C=C\CN MCULE-6310541400 [0,0,0,0,0,0|3,0,1]=4 245 B5R0.2 NC/C=C\CN MCULE-8765736519 [0,0,0,0,0,0|3,0,1]=4 246 B5R0.2 NCC#CCCl MCULE-3774554520 [0,0,0,0,0,0|3,0,1]=4 247 B5R0.2 NCC#CCCl MCULE-3851000158 [0,0,0,0,0,0|3,0,1]=4 248 B5R0.2 NCC#CCN MCULE-2193445650 [0,0,0,0,0,0|3,0,1]=4 249 B5R0.2 NCC#CCN MCULE-6401411060 [0,0,0,0,0,0|3,0,1]=4 250 B5R0.2 NCC#CCO MCULE-4844677613 [0,0,0,0,0,0|2,0,1]=3 251 B5R0.2 NCC#CCO MCULE-9095239812 [0,0,0,0,0,0|2,0,1]=3 252 B5R0.2 NCC=CCN MCULE-3768809289 [0,0,0,0,0,0|3,0,1]=4 253 B5R0.2 NCC=CCN MCULE-4004493343 [0,0,0,0,0,0|3,0,1]=4 254 B5R0.2 NCC=CCN MCULE-6780035248 [0,0,0,0,0,0|3,0,1]=4 255 B5R0.2 NCC=CCO MCULE-4993379992 [0,0,0,0,0,0|2,0,1]=3 256 B5R0.2 NCCCCBr MCULE-7095299053 [0,0,0,0,0,0|3,0,0]=3 257 B5R0.2 NCCCCBr MCULE-7716027825 [0,0,0,0,0,0|3,0,0]=3 258 B5R0.2 NCCCCCl MCULE-8484381726 [0,0,0,0,0,0|3,0,0]=3 259 B5R0.2 NCCCCCl MCULE-9917306082 [0,0,0,0,0,0|3,0,0]=3 260 B5R0.2 NCCCCF MCULE-4260727945 [0,0,0,0,0,0|3,0,0]=3 261 B5R0.2 NCCCCF MCULE-7716720921 [0,0,0,0,0,0|3,0,0]=3 262 B5R0.2 NCCCCN MCULE-3098044935 [0,0,0,0,0,0|3,0,0]=3 263 B5R0.2 NCCCCN MCULE-7898833229 [0,0,0,0,0,0|3,0,0]=3 264 B5R0.2 NCCCCN MCULE-8029479697 [0,0,0,0,0,0|3,0,0]=3 265 B5R0.2 NCCCCN MCULE-8509656776 [0,0,0,0,0,0|3,0,0]=3 266 B5R0.2 NCCCCO MCULE-7395674091 [0,0,0,0,0,0|2,0,0]=2 267 B5R0.2 NCCCCS MCULE-4353910418 [0,0,0,0,0,0|2,1,0]=3 268 B5R0.2 NCCCCS MCULE-9812416858 [0,0,0,0,0,0|2,1,0]=3 269 B5R0.2 NCCCNN MCULE-7657257572 [0,0,0,0,0,0|4,0,0]=4 270 B5R0.2 NCCCON MCULE-1071170242 [0,0,0,0,0,0|4,0,0]=4 271 B5R0.2 NCCCON MCULE-7767315563 [0,0,0,0,0,0|4,0,0]=4 272 B5R0.2 NNCCCO MCULE-5557482626 [0,0,0,0,0,0|3,0,0]=3 273 B5R0.2 NNCCCO MCULE-7351853032 [0,0,0,0,0,0|3,0,0]=3 274 B5R0.2 NNCCCO MCULE-7919314403 [0,0,0,0,0,0|3,0,0]=3 275 B5R0.2 NOCCCO MCULE-1072312935 [0,0,0,0,0,0|3,0,0]=3 276 B5R0.2 NOCCCO MCULE-3715520109 [0,0,0,0,0,0|3,0,0]=3 277 B5R0.2 NOCCCS MCULE-2063976508 [0,0,0,0,0,0|3,1,0]=4 278 B5R0.2 NOCCCS MCULE-3464018652 [0,0,0,0,0,0|3,1,0]=4 279 B5R0.2 O=C=NCCBr MCULE-9707894644 [0,0,0,0,0,0|3,0,1]=4 280 B5R0.2 O=C=NCCCl MCULE-8919918461 [0,0,0,0,0,0|3,0,1]=4 281 B5R0.2 O=CCCCBr MCULE-7239613396 [0,0,0,0,0,0|2,0,2]=4 282 B5R0.2 O=CCCCCl MCULE-3011225716 [0,0,0,0,0,0|2,0,2]=4 283 B5R0.2 O=CCCCI MCULE-3153720790 [0,0,0,0,0,0|2,0,2]=4 284 B5R0.2 O=CCCCO MCULE-8728420992 [0,0,0,0,0,0|2,0,1]=3 285 B5R0.2 O=CNCCO MCULE-3688614090 [0,0,0,0,0,0|2,0,1]=3 286 B5R0.2 O=COCCO MCULE-1922672843 [0,0,0,0,0,0|1,0,1]=2 287 B5R0.2 OC/C=C/CCl MCULE-4378785113 [0,0,0,0,0,0|2,0,1]=3 288 B5R0.2 OC/C=C/CO MCULE-4752272005 [0,0,0,0,0,0|2,0,1]=3 289 B5R0.2 OC/C=C\CO MCULE-2695577582 [0,0,0,0,0,0|2,0,1]=3 290 B5R0.2 OC=CCCBr MCULE-3964604828 [0,0,0,0,0,0|2,0,2]=4 291 B5R0.2 OC=CCCBr MCULE-5728835735 [0,0,0,0,0,0|2,0,2]=4 292 B5R0.2 OCC#CCBr MCULE-1662147427 [0,0,0,0,0,0|2,0,1]=3 293 B5R0.2 OCC#CCCl MCULE-9445494949 [0,0,0,0,0,0|2,0,1]=3 294 B5R0.2 OCC#CCO MCULE-2650636766 [0,0,0,0,0,0|2,0,1]=3 295 B5R0.2 OCC=CCCl MCULE-7597942117 [0,0,0,0,0,0|2,0,1]=3 296 B5R0.2 OCC=CCO MCULE-9559211408 [0,0,0,0,0,0|2,0,1]=3 297 B5R0.2 OCCCCBr MCULE-9231591925 [0,0,0,0,0,0|2,0,0]=2 298 B5R0.2 OCCCCCl MCULE-3507644812 [0,0,0,0,0,0|2,0,0]=2 299 B5R0.2 OCCCCF MCULE-9242285588 [0,0,0,0,0,0|2,0,0]=2 300 B5R0.2 OCCCCI MCULE-8723720522 [0,0,0,0,0,0|2,0,0]=2 301 B5R0.2 OCCCCO MCULE-2010022287 [0,0,0,0,0,0|2,0,0]=2 302 B5R0.2 OCCCCO MCULE-6551106098 [0,0,0,0,0,0|2,0,0]=2 303 B5R0.2 OCCCCS MCULE-8169490949 [0,0,0,0,0,0|2,0,0]=2 304 B5R0.2 OCCNCO MCULE-2141033453 [0,0,0,0,0,0|2,0,0]=2 305 B5R0.2 S=C=NCCBr MCULE-9583896675 [0,0,0,0,0,0|3,0,1]=4 306 B5R0.2 S=C=NCCCl MCULE-3919932972 [0,0,0,0,0,0|3,0,1]=4 307 B5R0.2 SCCCCS MCULE-6695609899 [0,0,0,0,0,0|2,1,0]=3 308 B4R0.2 BrCCCBr MCULE-6500110480 [1,0,0,0,0,0|2,0,0]=3 309 B4R0.2 BrCCCI MCULE-6470610840 [1,0,0,0,0,0|2,0,0]=3 310 B4R0.2 BrCOCBr MCULE-2371209322 [1,0,0,0,0,0|2,0,0]=3 311 B4R0.2 C#CCCBr MCULE-1495603480 [1,0,0,0,0,0|1,0,2]=4 312 B4R0.2 C#CCCC MCULE-1233806896 [1,0,0,0,0,0|1,0,1]=3 313 B4R0.2 C#CCCCl MCULE-5602517887 [1,0,0,0,0,0|1,0,2]=4 314 B4R0.2 C#CCCI MCULE-2832310719 [1,0,0,0,0,0|1,0,2]=4 315 B4R0.2 C#CCCN MCULE-1223656854 [1,0,0,0,0,0|1,0,2]=4 316 B4R0.2 C#CCCN MCULE-6408469965 [1,0,0,0,0,0|1,0,2]=4 317 B4R0.2 C#CCCO MCULE-1797559276 [1,0,0,0,0,0|0,0,2]=3 318 B4R0.2 C#CCCO MCULE-8743964065 [1,0,0,0,0,0|0,0,2]=3 319 B4R0.2 C#CCNC MCULE-9758975590 [1,0,0,0,0,0|2,0,1]=4 320 B4R0.2 C#CCNO MCULE-7210831528 [1,0,0,0,0,0|1,0,2]=4 321 B4R0.2 C#CCNO MCULE-8082854360 [1,0,0,0,0,0|1,0,2]=4 322 B4R0.2 C#CCOC MCULE-9172422462 [1,0,0,0,0,0|1,0,1]=3 323 B4R0.2 C#CCON MCULE-1220634713 [1,0,0,0,0,0|2,0,1]=4 324 B4R0.2 C#CCON MCULE-5781631200 [1,0,0,0,0,0|2,0,1]=4 325 B4R0.2 C#CCSC MCULE-6808040899 [1,0,0,0,0,0|1,1,1]=4 326 B4R0.2 C#COCC MCULE-1522528824 [1,0,0,0,0,0|0,0,2]=3 327 B4R0.2 C/C=C/CCl MCULE-9977493525 [1,0,0,0,0,0|1,0,2]=4 328 B4R0.2 C/C=C/CO MCULE-2383161163 [1,0,0,0,0,0|0,0,2]=3 329 B4R0.2 C/C=C/OC MCULE-3906920304 [1,0,0,0,0,0|1,0,2]=4 330 B4R0.2 C/C=C\CO MCULE-5924662327 [1,0,0,0,0,0|0,0,2]=3 331 B4R0.2 C=C=CCC MCULE-6123315571 [1,0,0,0,0,0|1,0,2]=4 332 B4R0.2 C=C=CCO MCULE-5424851896 [1,0,0,0,0,0|0,0,3]=4 333 B4R0.2 C=CCCBr MCULE-2890129103 [1,0,0,0,0,0|1,0,2]=4 334 B4R0.2 C=CCCC MCULE-8386546337 [1,0,0,0,0,0|1,0,1]=3 335 B4R0.2 C=CCCCl MCULE-5903789900 [1,0,0,0,0,0|1,0,2]=4 336 B4R0.2 C=CCCI MCULE-1055671394 [1,0,0,0,0,0|1,0,2]=4 337 B4R0.2 C=CCCN MCULE-2471716627 [1,0,0,0,0,0|1,0,2]=4 338 B4R0.2 C=CCCN MCULE-2881108697 [1,0,0,0,0,0|1,0,2]=4 339 B4R0.2 C=CCCO MCULE-4582400839 [1,0,0,0,0,0|0,0,2]=3 340 B4R0.2 C=CCNC MCULE-3335720336 [1,0,0,0,0,0|2,0,1]=4 341 B4R0.2 C=CCOC MCULE-3321225771 [1,0,0,0,0,0|1,0,1]=3 342 B4R0.2 C=CCON MCULE-2094787759 [1,0,0,0,0,0|2,0,1]=4 343 B4R0.2 C=CCON MCULE-6222602533 [1,0,0,0,0,0|2,0,1]=4 344 B4R0.2 C=CCSC MCULE-4452023915 [1,0,0,0,0,0|1,1,1]=4 345 B4R0.2 C=COCC MCULE-2569047033 [1,0,0,0,0,0|0,0,2]=3 346 B4R0.2 C=CSCC MCULE-8927374165 [1,0,0,0,0,0|0,1,2]=4 347 B4R0.2 CC#CCBr MCULE-3596191560 [1,0,0,0,0,0|1,0,2]=4 348 B4R0.2 CC#CCC MCULE-8848779220 [1,0,0,0,0,0|1,0,1]=3 349 B4R0.2 CC#CCI MCULE-3596701582 [1,0,0,0,0,0|1,0,2]=4 350 B4R0.2 CC#CCN MCULE-7027146471 [1,0,0,0,0,0|1,0,2]=4 351 B4R0.2 CC#CCN MCULE-9570644542 [1,0,0,0,0,0|1,0,2]=4 352 B4R0.2 CC#CCO MCULE-5096552076 [1,0,0,0,0,0|0,0,2]=3 353 B4R0.2 CC=CCBr MCULE-7855581866 [1,0,0,0,0,0|1,0,2]=4 354 B4R0.2 CC=CCC MCULE-5931905453 [1,0,0,0,0,0|1,0,1]=3 355 B4R0.2 CC=CCCl MCULE-3941962217 [1,0,0,0,0,0|1,0,2]=4 356 B4R0.2 CC=CCO MCULE-7490725844 [1,0,0,0,0,0|0,0,2]=3 357 B4R0.2 CC=COC MCULE-6712403535 [1,0,0,0,0,0|1,0,2]=4 358 B4R0.2 CC=CSC MCULE-5921906156 [1,0,0,0,0,0|2,0,1]=4 359 B4R0.2 CCC#CI MCULE-6466997582 [1,0,0,0,0,0|1,0,2]=4 360 B4R0.2 CCC=CBr MCULE-4471551501 [1,0,0,0,0,0|1,0,2]=4 361 B4R0.2 CCC=NO MCULE-9457280654 [1,0,0,0,0,0|1,0,1]=3 362 B4R0.2 CCCC#N MCULE-8571076087 [1,0,0,0,0,0|1,0,1]=3 363 B4R0.2 CCCC=O MCULE-8530391347 [1,0,0,0,0,0|0,0,2]=3 364 B4R0.2 CCCCBr MCULE-3390217131 [1,0,0,0,0,0|1,0,0]=2 365 B4R0.2 CCCCC MCULE-4643148765 [1,0,0,0,0,0|1,0,0]=2 366 B4R0.2 CCCCCl MCULE-5329900290 [1,0,0,0,0,0|1,0,0]=2 367 B4R0.2 CCCCF MCULE-7225760858 [1,0,0,0,0,0|1,0,0]=2 368 B4R0.2 CCCCI MCULE-1160974720 [1,0,0,0,0,0|1,0,0]=2 369 B4R0.2 CCCCN MCULE-1731874934 [1,0,0,0,0,0|1,0,0]=2 370 B4R0.2 CCCCN MCULE-4233278050 [1,0,0,0,0,0|1,0,0]=2 371 B4R0.2 CCCCN MCULE-5242069370 [1,0,0,0,0,0|1,0,0]=2 372 B4R0.2 CCCCN MCULE-7343835253 [1,0,0,0,0,0|1,0,0]=2 373 B4R0.2 CCCCO MCULE-1571156443 [1,0,0,0,0,0|0,0,0]=1 374 B4R0.2 CCCCS MCULE-9441213933 [1,0,0,0,0,0|0,1,0]=2 375 B4R0.2 CCCNC MCULE-2266616259 [1,0,0,0,0,0|2,0,0]=3 376 B4R0.2 CCCNC MCULE-7722796872 [1,0,0,0,0,0|2,0,0]=3 377 B4R0.2 CCCNN MCULE-4121438775 [1,0,0,0,0,0|2,0,0]=3 378 B4R0.2 CCCNN MCULE-5875592228 [1,0,0,0,0,0|2,0,0]=3 379 B4R0.2 CCCNN MCULE-9585694661 [1,0,0,0,0,0|2,0,0]=3 380 B4R0.2 CCCOC MCULE-5854067718 [1,0,0,0,0,0|1,0,0]=2 381 B4R0.2 CCCON MCULE-4800172637 [1,0,0,0,0,0|2,0,0]=3 382 B4R0.2 CCCON MCULE-7988781002 [1,0,0,0,0,0|2,0,0]=3 383 B4R0.2 CCCSC MCULE-8387041737 [1,0,0,0,0,0|1,1,0]=3 384 B4R0.2 CCN=C=O MCULE-6522145601 [1,0,0,0,0,0|1,0,2]=4 385 B4R0.2 CCN=C=S MCULE-9838756606 [1,0,0,0,0,0|1,1,1]=4 386 B4R0.2 CCNC=O MCULE-9309926274 [1,0,0,0,0,0|1,0,2]=4 387 B4R0.2 CCNCC MCULE-3395060353 [1,0,0,0,0,0|1,0,0]=2 388 B4R0.2 CCNCC MCULE-4374609736 [1,0,0,0,0,0|1,0,0]=2 389 B4R0.2 CCNCC MCULE-4555901025 [1,0,0,0,0,0|1,0,0]=2 390 B4R0.2 CCNCC MCULE-6895602113 [1,0,0,0,0,0|1,0,0]=2 391 B4R0.2 CCNOC MCULE-4797714235 [1,0,0,0,0,0|2,0,0]=3 392 B4R0.2 CCNOC MCULE-6486167423 [1,0,0,0,0,0|2,0,0]=3 393 B4R0.2 CCOC=N MCULE-5321655909 [1,0,0,0,0,0|1,0,1]=3 394 B4R0.2 CCOC=N MCULE-8158357614 [1,0,0,0,0,0|1,0,1]=3 395 B4R0.2 CCOC=O MCULE-6245072161 [1,0,0,0,0,0|0,0,2]=3 396 B4R0.2 CCOCBr MCULE-6644755987 [1,0,0,0,0,0|1,0,0]=2 397 B4R0.2 CCOCC MCULE-5665709021 [1,0,0,0,0,0|0,0,0]=1 398 B4R0.2 CCOCCl MCULE-5087992840 [1,0,0,0,0,0|1,0,0]=2 399 B4R0.2 CCONC MCULE-5446312516 [1,0,0,0,0,0|1,0,0]=2 400 B4R0.2 CCONC MCULE-7976027802 [1,0,0,0,0,0|1,0,0]=2 401 B4R0.2 CCSC#N MCULE-1270730084 [1,0,0,0,0,0|1,1,1]=4 402 B4R0.2 CCSCC MCULE-6480710239 [1,0,0,0,0,0|0,1,0]=2 403 B4R0.2 CCSCCl MCULE-3890542152 [1,0,0,0,0,0|1,1,0]=3 404 B4R0.2 CCSSC MCULE-9430585714 [1,0,0,0,0,0|1,1,0]=3 405 B4R0.2 CC[NH2+]CC MCULE-9899430356 [1,0,0,0,0,0|1,0,0]=2 406 B4R0.2 CNCC#N MCULE-1233170363 [1,0,0,0,0,0|2,0,1]=4 407 B4R0.2 CNCC#N MCULE-4334159739 [1,0,0,0,0,0|2,0,1]=4 408 B4R0.2 CNCC#N MCULE-8267124503 [1,0,0,0,0,0|2,0,1]=4 409 B4R0.2 CNCCBr MCULE-3708780806 [1,0,0,0,0,0|2,0,0]=3 410 B4R0.2 CNCCBr MCULE-6840755559 [1,0,0,0,0,0|2,0,0]=3 411 B4R0.2 CNCCCl MCULE-1666345560 [1,0,0,0,0,0|2,0,0]=3 412 B4R0.2 CNCCCl MCULE-8215813413 [1,0,0,0,0,0|2,0,0]=3 413 B4R0.2 CNCCF MCULE-3719880423 [1,0,0,0,0,0|2,0,0]=3 414 B4R0.2 CNCCF MCULE-3751701745 [1,0,0,0,0,0|2,0,0]=3 415 B4R0.2 CNCCI MCULE-7026781832 [1,0,0,0,0,0|2,0,0]=3 416 B4R0.2 CNCCI MCULE-8892686580 [1,0,0,0,0,0|2,0,0]=3 417 B4R0.2 CNCCN MCULE-2881688448 [1,0,0,0,0,0|2,0,0]=3 418 B4R0.2 CNCCN MCULE-7199403269 [1,0,0,0,0,0|2,0,0]=3 419 B4R0.2 CNCCO MCULE-7051900771 [1,0,0,0,0,0|1,0,0]=2 420 B4R0.2 CNCCO MCULE-7934732981 [1,0,0,0,0,0|1,0,0]=2 421 B4R0.2 CNCCS MCULE-6430516369 [1,0,0,0,0,0|1,1,0]=3 422 B4R0.2 COCC#N MCULE-9178522865 [1,0,0,0,0,0|1,0,1]=3 423 B4R0.2 COCC=O MCULE-9427361019 [1,0,0,0,0,0|0,0,2]=3 424 B4R0.2 COCCBr MCULE-8316331262 [1,0,0,0,0,0|1,0,0]=2 425 B4R0.2 COCCCl MCULE-8886627413 [1,0,0,0,0,0|1,0,0]=2 426 B4R0.2 COCCI MCULE-9391124374 [1,0,0,0,0,0|1,0,0]=2 427 B4R0.2 COCCN MCULE-5051556646 [1,0,0,0,0,0|1,0,0]=2 428 B4R0.2 COCCN MCULE-7519068386 [1,0,0,0,0,0|1,0,0]=2 429 B4R0.2 COCCO MCULE-4751927883 [1,0,0,0,0,0|0,0,0]=1 430 B4R0.2 COCCS MCULE-7803276094 [1,0,0,0,0,0|0,1,0]=2 431 B4R0.2 COCOC MCULE-8559076702 [1,0,0,0,0,0|2,0,0]=3 432 B4R0.2 COCON MCULE-6032854331 [1,0,0,0,0,0|2,0,0]=3 433 B4R0.2 CSCC#N MCULE-3607261611 [1,0,0,0,0,0|1,1,1]=4 434 B4R0.2 CSCCBr MCULE-1684461541 [1,0,0,0,0,0|1,1,0]=3 435 B4R0.2 CSCCCl MCULE-8593103756 [1,0,0,0,0,0|1,1,0]=3 436 B4R0.2 CSCCN MCULE-5168245255 [1,0,0,0,0,0|1,1,0]=3 437 B4R0.2 CSCCN MCULE-6275285732 [1,0,0,0,0,0|1,1,0]=3 438 B4R0.2 CSCCO MCULE-9706874325 [1,0,0,0,0,0|0,1,0]=2 439 B4R0.2 CSCSC MCULE-5603964020 [1,0,0,0,0,0|2,1,0]=4 440 B4R0.2 CSSSC MCULE-4175573612 [1,0,0,0,0,0|2,1,0]=4 441 B4R0.2 ClCCCBr MCULE-7937580875 [1,0,0,0,0,0|2,0,0]=3 442 B4R0.2 ClCCCCl MCULE-6693270397 [1,0,0,0,0,0|2,0,0]=3 443 B4R0.2 ClCCCI MCULE-1521526833 [1,0,0,0,0,0|2,0,0]=3 444 B4R0.2 ClCSCCl MCULE-5228778525 [1,0,0,0,0,0|2,1,0]=4 445 B4R0.2 FCCCBr MCULE-5674735753 [1,0,0,0,0,0|2,0,0]=3 446 B4R0.2 FCCCF MCULE-1803511350 [1,0,0,0,0,0|2,0,0]=3 447 B4R0.2 FCCCI MCULE-9287814857 [1,0,0,0,0,0|2,0,0]=3 448 B4R0.2 ICCCI MCULE-9849754168 [1,0,0,0,0,0|2,0,0]=3 449 B4R0.2 ICOCI MCULE-4901830231 [1,0,0,0,0,0|2,0,0]=3 450 B4R0.2 N#CCCBr MCULE-1744180602 [1,0,0,0,0,0|2,0,1]=4 451 B4R0.2 N#CCCCl MCULE-3511379481 [1,0,0,0,0,0|2,0,1]=4 452 B4R0.2 N#CCCI MCULE-1591942951 [1,0,0,0,0,0|2,0,1]=4 453 B4R0.2 N#CCCN MCULE-8482296338 [1,0,0,0,0,0|2,0,1]=4 454 B4R0.2 N#CCCN MCULE-9518086954 [1,0,0,0,0,0|2,0,1]=4 455 B4R0.2 N#CCCO MCULE-5098987368 [1,0,0,0,0,0|1,0,1]=3 456 B4R0.2 N#CCCS MCULE-7199964466 [1,0,0,0,0,0|1,1,1]=4 457 B4R0.2 N#CCNO MCULE-6808474875 [1,0,0,0,0,0|2,0,1]=4 458 B4R0.2 N#CCON MCULE-1849571406 [1,0,0,0,0,0|2,0,1]=4 459 B4R0.2 N#CCON MCULE-2156159928 [1,0,0,0,0,0|2,0,1]=4 460 B4R0.2 NCCCBr MCULE-5485748003 [1,0,0,0,0,0|2,0,0]=3 461 B4R0.2 NCCCBr MCULE-7072709972 [1,0,0,0,0,0|2,0,0]=3 462 B4R0.2 NCCCCl MCULE-1324157004 [1,0,0,0,0,0|2,0,0]=3 463 B4R0.2 NCCCCl MCULE-3667248190 [1,0,0,0,0,0|2,0,0]=3 464 B4R0.2 NCCCF MCULE-5215746973 [1,0,0,0,0,0|2,0,0]=3 465 B4R0.2 NCCCF MCULE-8077133369 [1,0,0,0,0,0|2,0,0]=3 466 B4R0.2 NCCCI MCULE-3534892097 [1,0,0,0,0,0|2,0,0]=3 467 B4R0.2 NCCCI MCULE-8010453546 [1,0,0,0,0,0|2,0,0]=3 468 B4R0.2 NCCCN MCULE-4293255820 [1,0,0,0,0,0|2,0,0]=3 469 B4R0.2 NCCCN MCULE-5041378433 [1,0,0,0,0,0|2,0,0]=3 470 B4R0.2 NCCCN MCULE-6944452060 [1,0,0,0,0,0|2,0,0]=3 471 B4R0.2 NCCCN MCULE-7375662153 [1,0,0,0,0,0|2,0,0]=3 472 B4R0.2 NCCCN MCULE-8277465929 [1,0,0,0,0,0|2,0,0]=3 473 B4R0.2 NCCCN MCULE-9929373126 [1,0,0,0,0,0|2,0,0]=3 474 B4R0.2 NCCCO MCULE-2851278356 [1,0,0,0,0,0|1,0,0]=2 475 B4R0.2 NCCCO MCULE-9698089092 [1,0,0,0,0,0|1,0,0]=2 476 B4R0.2 NCCCS MCULE-3994478020 [1,0,0,0,0,0|1,1,0]=3 477 B4R0.2 NCCCS MCULE-7730973866 [1,0,0,0,0,0|1,1,0]=3 478 B4R0.2 NCCON MCULE-3613980902 [1,0,0,0,0,0|2,0,0]=3 479 B4R0.2 NCCON MCULE-7030217952 [1,0,0,0,0,0|2,0,0]=3 480 B4R0.2 NCCON MCULE-8959912781 [1,0,0,0,0,0|2,0,0]=3 481 B4R0.2 NNCCF MCULE-2712460031 [1,0,0,0,0,0|3,0,0]=4 482 B4R0.2 NNCCF MCULE-8505927457 [1,0,0,0,0,0|3,0,0]=4 483 B4R0.2 NNCCO MCULE-1290652744 [1,0,0,0,0,0|2,0,0]=3 484 B4R0.2 NOCCBr MCULE-2796346082 [1,0,0,0,0,0|2,0,0]=3 485 B4R0.2 NOCCBr MCULE-5636354898 [1,0,0,0,0,0|2,0,0]=3 486 B4R0.2 NOCCCl MCULE-5981688956 [1,0,0,0,0,0|2,0,0]=3 487 B4R0.2 NOCCF MCULE-1813481600 [1,0,0,0,0,0|2,0,0]=3 488 B4R0.2 NOCCF MCULE-2993254805 [1,0,0,0,0,0|2,0,0]=3 489 B4R0.2 NOCCO MCULE-2545004367 [1,0,0,0,0,0|1,0,0]=2 490 B4R0.2 O=CCCBr MCULE-4107157458 [1,0,0,0,0,0|1,0,2]=4 491 B4R0.2 O=CCCCl MCULE-5863929313 [1,0,0,0,0,0|1,0,2]=4 492 B4R0.2 O=CCCI MCULE-9771140462 [1,0,0,0,0,0|1,0,2]=4 493 B4R0.2 O=CCCO MCULE-1685289763 [1,0,0,0,0,0|1,0,1]=3 494 B4R0.2 OC=CCCl MCULE-4750991393 [1,0,0,0,0,0|1,0,2]=4 495 B4R0.2 OCC#CBr MCULE-2495653455 [1,0,0,0,0,0|1,0,2]=4 496 B4R0.2 OCC#CI MCULE-1101149708 [1,0,0,0,0,0|1,0,2]=4 497 B4R0.2 OCC=CBr MCULE-4636104289 [1,0,0,0,0,0|1,0,2]=4 498 B4R0.2 OCC=CCl MCULE-2110127594 [1,0,0,0,0,0|1,0,2]=4 499 B4R0.2 OCCCBr MCULE-3450011527 [1,0,0,0,0,0|1,0,0]=2 500 B4R0.2 OCCCCl MCULE-2319230957 [1,0,0,0,0,0|1,0,0]=2 501 B4R0.2 OCCCF MCULE-2347934403 [1,0,0,0,0,0|1,0,0]=2 502 B4R0.2 OCCCI MCULE-5200713967 [1,0,0,0,0,0|1,0,0]=2 503 B4R0.2 OCCCO MCULE-5166824786 [1,0,0,0,0,0|1,0,0]=2 504 B4R0.2 OCCCS MCULE-7930164048 [1,0,0,0,0,0|1,0,0]=2 505 B4R0.2 ON=CCCl MCULE-5736695742 [1,0,0,0,0,0|2,0,1]=4 506 B4R0.2 PCCCP MCULE-6048146071 [1,0,0,0,0,0|2,0,0]=3 507 B4R0.2 SCCCBr MCULE-4627341228 [1,0,0,0,0,0|1,1,0]=3 508 B4R0.2 SCCCCl MCULE-6410389127 [1,0,0,0,0,0|1,1,0]=3 509 B4R0.2 SCCCS MCULE-8220630729 [1,0,0,0,0,0|1,1,0]=3 510 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [1,0,0,0,0,0|1,0,0]=2 511 B4R0.2 [NH3+]OCO[NH3+] MCULE-1014646507 [1,0,0,0,0,0|3,0,0]=4 512 B4R0.2 [NH3+]OCO[NH3+] MCULE-2130820760 [1,0,0,0,0,0|3,0,0]=4 513 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [0,1,0,0,0,0|1,0,2]=4 514 B6R0.1 C#CC(N)CCC MCULE-1649795667 [0,1,0,0,0,0|2,0,1]=4 515 B6R0.1 C#CC(N)CCC MCULE-4074347601 [0,1,0,0,0,0|2,0,1]=4 516 B6R0.1 C#CC(O)CCC MCULE-6152066005 [0,1,0,0,0,0|2,0,1]=4 517 B6R0.1 C#CCC(C)CO MCULE-6139260605 [0,1,0,0,0,0|1,0,2]=4 518 B6R0.1 C#CCC(N)CC MCULE-4259544439 [0,1,0,0,0,0|2,0,1]=4 519 B6R0.1 C#CCC(N)CO MCULE-5669035635 [0,1,0,0,0,0|1,0,2]=4 520 B6R0.1 C#CCC(O)CC MCULE-8783941008 [0,1,0,0,0,0|2,0,1]=4 521 B6R0.1 C#CCN(C)CC MCULE-4046146529 [0,1,0,0,0,0|2,0,1]=4 522 B6R0.1 C#CCN(C)CC MCULE-6846440848 [0,1,0,0,0,0|2,0,1]=4 523 B6R0.1 C#CC[C@@H](N)CO MCULE-2638776426 [0,1,0,0,0,0|1,0,2]=4 524 B6R0.1 C#CC[C@@H](N)CO MCULE-7710952185 [0,1,0,0,0,0|1,0,2]=4 525 B6R0.1 C#CC[C@H](N)CO MCULE-8069295628 [0,1,0,0,0,0|1,0,2]=4 526 B6R0.1 C#CC[C@H](N)CO MCULE-9440234580 [0,1,0,0,0,0|1,0,2]=4 527 B6R0.1 C=C(CC)CCO MCULE-5317656776 [0,1,0,0,0,0|1,0,0]=2 528 B6R0.1 C=C=CC(C)CO MCULE-4111632331 [0,1,0,0,0,0|1,0,2]=4 529 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,1,0,0,0,0|1,0,2]=4 530 B6R0.1 C=CC(C)CCC MCULE-2692803387 [0,1,0,0,0,0|2,0,1]=4 531 B6R0.1 C=CC(C)CCO MCULE-2890369298 [0,1,0,0,0,0|1,0,2]=4 532 B6R0.1 C=CC(N)CCO MCULE-7781906138 [0,1,0,0,0,0|1,0,2]=4 533 B6R0.1 C=CC(O)CCC MCULE-3664453040 [0,1,0,0,0,0|2,0,1]=4 534 B6R0.1 C=CCC(C)CC MCULE-8680856865 [0,1,0,0,0,0|2,0,1]=4 535 B6R0.1 C=CCC(C)CO MCULE-9174943108 [0,1,0,0,0,0|1,0,2]=4 536 B6R0.1 C=CCC(N)CC MCULE-2309097248 [0,1,0,0,0,0|2,0,1]=4 537 B6R0.1 C=CCC(N)CC MCULE-8356954197 [0,1,0,0,0,0|2,0,1]=4 538 B6R0.1 C=CCC(N)CO MCULE-3854217705 [0,1,0,0,0,0|1,0,2]=4 539 B6R0.1 C=CCC(N)CO MCULE-6104194102 [0,1,0,0,0,0|1,0,2]=4 540 B6R0.1 C=CCC(N)CO MCULE-6473126335 [0,1,0,0,0,0|1,0,2]=4 541 B6R0.1 C=CCC(N)CO MCULE-8430673873 [0,1,0,0,0,0|1,0,2]=4 542 B6R0.1 C=CCC(O)CC MCULE-1497539816 [0,1,0,0,0,0|2,0,1]=4 543 B6R0.1 C=CC[C@@H](N)CO MCULE-1869015815 [0,1,0,0,0,0|1,0,2]=4 544 B6R0.1 C=CC[C@@H](N)CO MCULE-2792980070 [0,1,0,0,0,0|1,0,2]=4 545 B6R0.1 C=CC[C@@H](N)CO MCULE-3168704187 [0,1,0,0,0,0|1,0,2]=4 546 B6R0.1 C=CC[C@@H](N)CO MCULE-4796522209 [0,1,0,0,0,0|1,0,2]=4 547 B6R0.1 C=CC[C@@H](O)CC MCULE-3259102701 [0,1,0,0,0,0|2,0,1]=4 548 B6R0.1 C=CC[C@H](N)CO MCULE-2427943513 [0,1,0,0,0,0|1,0,2]=4 549 B6R0.1 C=CC[C@H](N)CO MCULE-4244461120 [0,1,0,0,0,0|1,0,2]=4 550 B6R0.1 C=CC[C@H](N)CO MCULE-6760610212 [0,1,0,0,0,0|1,0,2]=4 551 B6R0.1 C=CC[C@H](N)CO MCULE-7914934929 [0,1,0,0,0,0|1,0,2]=4 552 B6R0.1 C=CC[C@H](O)CC MCULE-6527977219 [0,1,0,0,0,0|2,0,1]=4 553 B6R0.1 CC#CC(O)CC MCULE-9870271888 [0,1,0,0,0,0|2,0,1]=4 554 B6R0.1 CC(CN)CCN MCULE-2719332037 [0,1,0,0,0,0|3,0,0]=4 555 B6R0.1 CC(CN)CCN MCULE-4200375624 [0,1,0,0,0,0|3,0,0]=4 556 B6R0.1 CC(CN)CCO MCULE-5515163518 [0,1,0,0,0,0|2,0,0]=3 557 B6R0.1 CC(CO)CCN MCULE-9900244005 [0,1,0,0,0,0|2,0,0]=3 558 B6R0.1 CC(CO)CCO MCULE-5240961149 [0,1,0,0,0,0|2,0,0]=3 559 B6R0.1 CC(CO)CCO MCULE-8678967805 [0,1,0,0,0,0|2,0,0]=3 560 B6R0.1 CC=C[C@@H](N)CO MCULE-4690559736 [0,1,0,0,0,0|1,0,1]=3 561 B6R0.1 CC=C[C@@H](N)CO MCULE-5852475953 [0,1,0,0,0,0|1,0,1]=3 562 B6R0.1 CC=C[C@H](N)CO MCULE-6168992245 [0,1,0,0,0,0|1,0,1]=3 563 B6R0.1 CC=C[C@H](N)CO MCULE-6971252398 [0,1,0,0,0,0|1,0,1]=3 564 B6R0.1 CCC(=CCO)C MCULE-5264054153 [0,1,0,0,0,0|1,0,1]=3 565 B6R0.1 CCC(=O)CC#N MCULE-6150629588 [0,1,0,0,0,0|2,0,1]=4 566 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,1,0,0,0,0|3,0,0]=4 567 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,1,0,0,0,0|3,0,0]=4 568 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,1,0,0,0,0|3,0,0]=4 569 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,1,0,0,0,0|3,0,0]=4 570 B6R0.1 CCC(=O)OCCl MCULE-6975707373 [0,1,0,0,0,0|2,0,1]=4 571 B6R0.1 CCC(Br)COC MCULE-7942540965 [0,1,0,0,0,0|3,0,0]=4 572 B6R0.1 CCC(C)C=NO MCULE-2829500970 [0,1,0,0,0,0|2,0,1]=4 573 B6R0.1 CCC(C)CC#N MCULE-8784266918 [0,1,0,0,0,0|2,0,1]=4 574 B6R0.1 CCC(C)CC=O MCULE-9143756592 [0,1,0,0,0,0|1,0,2]=4 575 B6R0.1 CCC(C)CCBr MCULE-6033010731 [0,1,0,0,0,0|2,0,0]=3 576 B6R0.1 CCC(C)CCCl MCULE-2069721626 [0,1,0,0,0,0|2,0,0]=3 577 B6R0.1 CCC(C)CCN MCULE-4140800594 [0,1,0,0,0,0|2,0,0]=3 578 B6R0.1 CCC(C)CCN MCULE-5509248218 [0,1,0,0,0,0|2,0,0]=3 579 B6R0.1 CCC(C)CCO MCULE-6482427735 [0,1,0,0,0,0|1,0,0]=2 580 B6R0.1 CCC(C)CNC MCULE-1998406301 [0,1,0,0,0,0|3,0,0]=4 581 B6R0.1 CCC(C)CNC MCULE-5957910094 [0,1,0,0,0,0|3,0,0]=4 582 B6R0.1 CCC(C)CON MCULE-7033012303 [0,1,0,0,0,0|3,0,0]=4 583 B6R0.1 CCC(C)OC=O MCULE-9361787208 [0,1,0,0,0,0|2,0,1]=4 584 B6R0.1 CCC(N)CC#N MCULE-9550652690 [0,1,0,0,0,0|2,0,1]=4 585 B6R0.1 CCC(N)CCN MCULE-8956610037 [0,1,0,0,0,0|2,0,0]=3 586 B6R0.1 CCC(N)CCO MCULE-1511155206 [0,1,0,0,0,0|1,0,0]=2 587 B6R0.1 CCC(N)CCO MCULE-5525302643 [0,1,0,0,0,0|1,0,0]=2 588 B6R0.1 CCC(N)COC MCULE-2103613859 [0,1,0,0,0,0|3,0,0]=4 589 B6R0.1 CCC(N)COC MCULE-5835446359 [0,1,0,0,0,0|3,0,0]=4 590 B6R0.1 CCC(N)CSC MCULE-9145513729 [0,1,0,0,0,0|3,0,0]=4 591 B6R0.1 CCC(O)CC#N MCULE-2542710031 [0,1,0,0,0,0|2,0,1]=4 592 B6R0.1 CCC(O)CCN MCULE-5387303971 [0,1,0,0,0,0|2,0,0]=3 593 B6R0.1 CCC(O)CCO MCULE-5156075792 [0,1,0,0,0,0|1,0,0]=2 594 B6R0.1 CCC(O)CNC MCULE-2490431367 [0,1,0,0,0,0|3,0,0]=4 595 B6R0.1 CCC(O)CNN MCULE-1038166714 [0,1,0,0,0,0|3,0,0]=4 596 B6R0.1 CCC(O)CNN MCULE-6391104058 [0,1,0,0,0,0|3,0,0]=4 597 B6R0.1 CCC(O)COC MCULE-6751000060 [0,1,0,0,0,0|3,0,0]=4 598 B6R0.1 CCC(O)CSC MCULE-3582683720 [0,1,0,0,0,0|3,0,0]=4 599 B6R0.1 CCC(S)CCO MCULE-4193788852 [0,1,0,0,0,0|1,0,0]=2 600 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [0,1,0,0,0,0|2,0,1]=4 601 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [0,1,0,0,0,0|2,0,1]=4 602 B6R0.1 CCCC(=NO)C MCULE-6437787263 [0,1,0,0,0,0|2,0,1]=4 603 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [0,1,0,0,0,0|2,0,1]=4 604 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,1,0,0,0,0|2,0,0]=3 605 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [0,1,0,0,0,0|2,0,1]=4 606 B6R0.1 CCCC(=O)CN MCULE-4663263123 [0,1,0,0,0,0|2,0,1]=4 607 B6R0.1 CCCC(=O)CN MCULE-6326368932 [0,1,0,0,0,0|2,0,1]=4 608 B6R0.1 CCCC(=O)CO MCULE-6518249412 [0,1,0,0,0,0|1,0,1]=3 609 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,1,0,0,0,0|3,0,0]=4 610 B6R0.1 CCCC(=O)NO MCULE-8710375368 [0,1,0,0,0,0|2,0,1]=4 611 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,1,0,0,0,0|3,0,0]=4 612 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,1,0,0,0,0|3,0,0]=4 613 B6R0.1 CCCC(=S)OC MCULE-8125476093 [0,1,0,0,0,0|3,0,0]=4 614 B6R0.1 CCCC(Br)CC MCULE-9116433502 [0,1,0,0,0,0|2,0,0]=3 615 B6R0.1 CCCC(C)C#N MCULE-2492294131 [0,1,0,0,0,0|2,0,1]=4 616 B6R0.1 CCCC(C)C=O MCULE-9756444218 [0,1,0,0,0,0|1,0,2]=4 617 B6R0.1 CCCC(C)CBr MCULE-3437352091 [0,1,0,0,0,0|2,0,0]=3 618 B6R0.1 CCCC(C)CC MCULE-7082933967 [0,1,0,0,0,0|2,0,0]=3 619 B6R0.1 CCCC(C)CCl MCULE-2381010454 [0,1,0,0,0,0|2,0,0]=3 620 B6R0.1 CCCC(C)CN MCULE-9552289739 [0,1,0,0,0,0|2,0,0]=3 621 B6R0.1 CCCC(C)CO MCULE-9777250826 [0,1,0,0,0,0|1,0,0]=2 622 B6R0.1 CCCC(C)NC MCULE-1560121168 [0,1,0,0,0,0|3,0,0]=4 623 B6R0.1 CCCC(C)NC MCULE-2169396338 [0,1,0,0,0,0|3,0,0]=4 624 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [0,1,0,0,0,0|2,0,0]=3 625 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [0,1,0,0,0,0|2,0,0]=3 626 B6R0.1 CCCC(N)C#N MCULE-6830545935 [0,1,0,0,0,0|2,0,1]=4 627 B6R0.1 CCCC(N)C#N MCULE-9818121096 [0,1,0,0,0,0|2,0,1]=4 628 B6R0.1 CCCC(N)CC MCULE-5349906741 [0,1,0,0,0,0|2,0,0]=3 629 B6R0.1 CCCC(N)CC MCULE-7172418373 [0,1,0,0,0,0|2,0,0]=3 630 B6R0.1 CCCC(N)CN MCULE-8606218569 [0,1,0,0,0,0|2,0,0]=3 631 B6R0.1 CCCC(N)CO MCULE-3404967504 [0,1,0,0,0,0|1,0,0]=2 632 B6R0.1 CCCC(N)CO MCULE-3802448518 [0,1,0,0,0,0|1,0,0]=2 633 B6R0.1 CCCC(N)CO MCULE-4259078445 [0,1,0,0,0,0|1,0,0]=2 634 B6R0.1 CCCC(N)CO MCULE-6425025734 [0,1,0,0,0,0|1,0,0]=2 635 B6R0.1 CCCC(O)C#N MCULE-7017059503 [0,1,0,0,0,0|2,0,1]=4 636 B6R0.1 CCCC(O)CBr MCULE-5186252424 [0,1,0,0,0,0|2,0,0]=3 637 B6R0.1 CCCC(O)CC MCULE-9504041935 [0,1,0,0,0,0|2,0,0]=3 638 B6R0.1 CCCC(O)CCl MCULE-4737360217 [0,1,0,0,0,0|2,0,0]=3 639 B6R0.1 CCCC(O)CN MCULE-9402934997 [0,1,0,0,0,0|2,0,0]=3 640 B6R0.1 CCCC(O)CO MCULE-5124107719 [0,1,0,0,0,0|1,0,0]=2 641 B6R0.1 CCCC(S)CC MCULE-1322481338 [0,1,0,0,0,0|2,0,0]=3 642 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [0,1,0,0,0,0|2,0,0]=3 643 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [0,1,0,0,0,0|2,0,0]=3 644 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [0,1,0,0,0,0|1,0,0]=2 645 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [0,1,0,0,0,0|1,0,0]=2 646 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [0,1,0,0,0,0|1,0,0]=2 647 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [0,1,0,0,0,0|2,0,0]=3 648 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [0,1,0,0,0,0|2,0,0]=3 649 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [0,1,0,0,0,0|2,0,0]=3 650 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [0,1,0,0,0,0|1,0,0]=2 651 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [0,1,0,0,0,0|1,0,0]=2 652 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [0,1,0,0,0,0|1,0,0]=2 653 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [0,1,0,0,0,0|1,0,0]=2 654 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [0,1,0,0,0,0|2,0,0]=3 655 B6R0.1 CCN(C)CCCl MCULE-4264927085 [0,1,0,0,0,0|2,0,0]=3 656 B6R0.1 CCN(C)CCCl MCULE-8125659652 [0,1,0,0,0,0|2,0,0]=3 657 B6R0.1 CCN(C)CCN MCULE-9503910262 [0,1,0,0,0,0|2,0,0]=3 658 B6R0.1 CCN(C)CCO MCULE-5519271145 [0,1,0,0,0,0|1,0,0]=2 659 B6R0.1 CCN(C)CCS MCULE-9974758531 [0,1,0,0,0,0|1,1,0]=3 660 B6R0.1 CCN(N)CCO MCULE-7988723724 [0,1,0,0,0,0|1,0,0]=2 661 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [0,1,0,0,0,0|2,0,1]=4 662 B6R0.1 CCNC(=O)CC MCULE-8820594723 [0,1,0,0,0,0|2,0,1]=4 663 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [0,1,0,0,0,0|2,0,1]=4 664 B6R0.1 CCNC(=O)CN MCULE-1913543460 [0,1,0,0,0,0|2,0,1]=4 665 B6R0.1 CCNC(=O)CN MCULE-5473845751 [0,1,0,0,0,0|2,0,1]=4 666 B6R0.1 CCNC(=O)CO MCULE-1386307800 [0,1,0,0,0,0|1,0,1]=3 667 B6R0.1 CCNC(=O)NO MCULE-3264850022 [0,1,0,0,0,0|2,0,1]=4 668 B6R0.1 CCNC(C)C#N MCULE-2197533334 [0,1,0,0,0,0|2,0,1]=4 669 B6R0.1 CCNC(C)C#N MCULE-2463800188 [0,1,0,0,0,0|2,0,1]=4 670 B6R0.1 CCNC(C)CC MCULE-1017617081 [0,1,0,0,0,0|2,0,0]=3 671 B6R0.1 CCNC(C)CC MCULE-2691229640 [0,1,0,0,0,0|2,0,0]=3 672 B6R0.1 CCNC(C)CO MCULE-4344397973 [0,1,0,0,0,0|1,0,0]=2 673 B6R0.1 CCN[C@@H](C)CO MCULE-5648721449 [0,1,0,0,0,0|1,0,0]=2 674 B6R0.1 CCN[C@H](C)CO MCULE-8047465405 [0,1,0,0,0,0|1,0,0]=2 675 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [0,1,0,0,0,0|1,0,1]=3 676 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [0,1,0,0,0,0|1,0,1]=3 677 B6R0.1 CCOC(=N)CC MCULE-4645506860 [0,1,0,0,0,0|1,0,1]=3 678 B6R0.1 CCOC(=N)CC MCULE-9526837631 [0,1,0,0,0,0|1,0,1]=3 679 B6R0.1 CCOC(=N)CCl MCULE-6291047852 [0,1,0,0,0,0|1,0,1]=3 680 B6R0.1 CCOC(=N)CCl MCULE-9207251975 [0,1,0,0,0,0|1,0,1]=3 681 B6R0.1 CCOC(=NO)C MCULE-6964305821 [0,1,0,0,0,0|1,0,1]=3 682 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [0,1,0,0,0,0|1,0,2]=4 683 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,1,0,0,0,0|0,0,3]=4 684 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [0,1,0,0,0,0|1,0,1]=3 685 B6R0.1 CCOC(=O)CC MCULE-1639864693 [0,1,0,0,0,0|1,0,1]=3 686 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [0,1,0,0,0,0|1,0,1]=3 687 B6R0.1 CCOC(=O)CF MCULE-1926097423 [0,1,0,0,0,0|1,0,1]=3 688 B6R0.1 CCOC(=O)CI MCULE-9898762324 [0,1,0,0,0,0|1,0,1]=3 689 B6R0.1 CCOC(=O)CN MCULE-2185173056 [0,1,0,0,0,0|1,0,1]=3 690 B6R0.1 CCOC(=O)CN MCULE-2628607025 [0,1,0,0,0,0|1,0,1]=3 691 B6R0.1 CCOC(=O)CO MCULE-8121340151 [0,1,0,0,0,0|0,0,1]=2 692 B6R0.1 CCOC(=O)CS MCULE-3354026239 [0,1,0,0,0,0|0,1,1]=3 693 B6R0.1 CCOC(=O)NC MCULE-5506841198 [0,1,0,0,0,0|2,0,1]=4 694 B6R0.1 CCOC(=O)NN MCULE-9872948119 [0,1,0,0,0,0|2,0,1]=4 695 B6R0.1 CCOC(=O)NO MCULE-4701193610 [0,1,0,0,0,0|1,0,1]=3 696 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,1,0,0,0,0|2,0,1]=4 697 B6R0.1 CCOC(=S)SC MCULE-6959447720 [0,1,0,0,0,0|2,0,1]=4 698 B6R0.1 CCOC(C)CC MCULE-5049998907 [0,1,0,0,0,0|1,0,0]=2 699 B6R0.1 CCOC(C)CN MCULE-2322112215 [0,1,0,0,0,0|1,0,0]=2 700 B6R0.1 CCOC(C)CN MCULE-7307949125 [0,1,0,0,0,0|1,0,0]=2 701 B6R0.1 CCOC(C)CO MCULE-1592146913 [0,1,0,0,0,0|0,0,0]=1 702 B6R0.1 CCOC(Cl)CCl MCULE-2309448343 [0,1,0,0,0,0|1,0,0]=2 703 B6R0.1 CCOS(=O)CC MCULE-4858180441 [0,1,0,0,0,0|2,0,0]=3 704 B6R0.1 CCS(=O)CCCl MCULE-1910591721 [0,1,0,0,0,0|1,1,0]=3 705 B6R0.1 CCS(=O)CCN MCULE-7201812983 [0,1,0,0,0,0|1,1,0]=3 706 B6R0.1 CCS(=O)CCN MCULE-7831905163 [0,1,0,0,0,0|1,1,0]=3 707 B6R0.1 CCS(=O)CCO MCULE-8290368918 [0,1,0,0,0,0|0,1,0]=2 708 B6R0.1 CCSC(=O)CC MCULE-6361738004 [0,1,0,0,0,0|1,1,1]=4 709 B6R0.1 CCSC(C)C#N MCULE-1159924867 [0,1,0,0,0,0|1,1,1]=4 710 B6R0.1 CC[C@@H](N)CC#N MCULE-3694594576 [0,1,0,0,0,0|2,0,1]=4 711 B6R0.1 CC[C@@H](N)CC#N MCULE-9083117229 [0,1,0,0,0,0|2,0,1]=4 712 B6R0.1 CC[C@@H](N)COC MCULE-2231338404 [0,1,0,0,0,0|3,0,0]=4 713 B6R0.1 CC[C@@H](N)COC MCULE-2931188781 [0,1,0,0,0,0|3,0,0]=4 714 B6R0.1 CC[C@@H](N)COC MCULE-5773677141 [0,1,0,0,0,0|3,0,0]=4 715 B6R0.1 CC[C@@H](N)COC MCULE-5939905142 [0,1,0,0,0,0|3,0,0]=4 716 B6R0.1 CC[C@@H](O)CC#N MCULE-5921416613 [0,1,0,0,0,0|2,0,1]=4 717 B6R0.1 CC[C@@H](O)CC#N MCULE-8527710778 [0,1,0,0,0,0|2,0,1]=4 718 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [0,1,0,0,0,0|1,0,0]=2 719 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [0,1,0,0,0,0|1,0,0]=2 720 B6R0.1 CC[C@H](N)CC#N MCULE-9692545503 [0,1,0,0,0,0|2,0,1]=4 721 B6R0.1 CC[C@H](N)COC MCULE-1115072226 [0,1,0,0,0,0|3,0,0]=4 722 B6R0.1 CC[C@H](N)COC MCULE-3917835289 [0,1,0,0,0,0|3,0,0]=4 723 B6R0.1 CC[C@H](N)COC MCULE-8706423122 [0,1,0,0,0,0|3,0,0]=4 724 B6R0.1 CC[C@H](N)COC MCULE-9406311547 [0,1,0,0,0,0|3,0,0]=4 725 B6R0.1 CN(C=O)CCO MCULE-3588371476 [0,1,0,0,0,0|2,0,1]=4 726 B6R0.1 CN(CCO)N=O MCULE-3975606321 [0,1,0,0,0,0|3,0,0]=4 727 B6R0.1 CNC(=O)CCBr MCULE-9239224841 [0,1,0,0,0,0|3,0,0]=4 728 B6R0.1 CNC(=O)CCCl MCULE-7130866366 [0,1,0,0,0,0|3,0,0]=4 729 B6R0.1 CNC(=O)CCN MCULE-1374127264 [0,1,0,0,0,0|3,0,0]=4 730 B6R0.1 CNC(=O)CCN MCULE-3948893656 [0,1,0,0,0,0|3,0,0]=4 731 B6R0.1 CNC(=O)CCO MCULE-3222339741 [0,1,0,0,0,0|2,0,0]=3 732 B6R0.1 CNC(=O)CCS MCULE-2385806944 [0,1,0,0,0,0|2,1,0]=4 733 B6R0.1 CNC(=S)NCO MCULE-2829573844 [0,1,0,0,0,0|3,0,0]=4 734 B6R0.1 CNC(C)CCO MCULE-4722422254 [0,1,0,0,0,0|2,0,0]=3 735 B6R0.1 CNCC(C)CN MCULE-1889673811 [0,1,0,0,0,0|3,0,0]=4 736 B6R0.1 CNCC(C)CO MCULE-6329429747 [0,1,0,0,0,0|2,0,0]=3 737 B6R0.1 CNCC(O)CF MCULE-3368370486 [0,1,0,0,0,0|3,0,0]=4 738 B6R0.1 CNCC(O)CN MCULE-1077260629 [0,1,0,0,0,0|3,0,0]=4 739 B6R0.1 CNCC(O)CO MCULE-4566952448 [0,1,0,0,0,0|2,0,0]=3 740 B6R0.1 CNC[C@H](O)CO MCULE-3410453252 [0,1,0,0,0,0|2,0,0]=3 741 B6R0.1 CNN(C)CCN MCULE-3863653213 [0,1,0,0,0,0|3,0,0]=4 742 B6R0.1 COC(=N)CCCl MCULE-1997539408 [0,1,0,0,0,0|3,0,0]=4 743 B6R0.1 COC(=N)CCCl MCULE-2235564076 [0,1,0,0,0,0|3,0,0]=4 744 B6R0.1 COC(=N)CCO MCULE-1904978557 [0,1,0,0,0,0|2,0,0]=3 745 B6R0.1 COC(=N)CCO MCULE-8146089973 [0,1,0,0,0,0|2,0,0]=3 746 B6R0.1 COC(=O)CCBr MCULE-3565567444 [0,1,0,0,0,0|3,0,0]=4 747 B6R0.1 COC(=O)CCCl MCULE-5034007224 [0,1,0,0,0,0|3,0,0]=4 748 B6R0.1 COC(=O)CCI MCULE-5984806612 [0,1,0,0,0,0|3,0,0]=4 749 B6R0.1 COC(=O)CCN MCULE-2306060188 [0,1,0,0,0,0|3,0,0]=4 750 B6R0.1 COC(=O)CCN MCULE-8245275833 [0,1,0,0,0,0|3,0,0]=4 751 B6R0.1 COC(=O)CCO MCULE-8538834260 [0,1,0,0,0,0|2,0,0]=3 752 B6R0.1 COC(=O)CCS MCULE-1695345183 [0,1,0,0,0,0|2,1,0]=4 753 B6R0.1 COC(C)CCN MCULE-8081876282 [0,1,0,0,0,0|3,0,0]=4 754 B6R0.1 COC(C)CCN MCULE-8892057529 [0,1,0,0,0,0|3,0,0]=4 755 B6R0.1 COC(C)CCO MCULE-7396381165 [0,1,0,0,0,0|2,0,0]=3 756 B6R0.1 COCC(C)CN MCULE-3223901774 [0,1,0,0,0,0|3,0,0]=4 757 B6R0.1 COCC(C)CO MCULE-7663064542 [0,1,0,0,0,0|2,0,0]=3 758 B6R0.1 COCC(F)CN MCULE-2821685967 [0,1,0,0,0,0|3,0,0]=4 759 B6R0.1 COCC(F)CN MCULE-9691951401 [0,1,0,0,0,0|3,0,0]=4 760 B6R0.1 COCC(N)CN MCULE-1244199319 [0,1,0,0,0,0|3,0,0]=4 761 B6R0.1 COCC(N)CO MCULE-2141613120 [0,1,0,0,0,0|2,0,0]=3 762 B6R0.1 COCC(N)CO MCULE-3194232042 [0,1,0,0,0,0|2,0,0]=3 763 B6R0.1 COCC(N)CO MCULE-6545937769 [0,1,0,0,0,0|2,0,0]=3 764 B6R0.1 COCC(N)CO MCULE-7989665777 [0,1,0,0,0,0|2,0,0]=3 765 B6R0.1 COCC(O)CBr MCULE-6900294714 [0,1,0,0,0,0|3,0,0]=4 766 B6R0.1 COCC(O)CCl MCULE-9314630227 [0,1,0,0,0,0|3,0,0]=4 767 B6R0.1 COCC(O)CF MCULE-1938415887 [0,1,0,0,0,0|3,0,0]=4 768 B6R0.1 COCC(O)CN MCULE-2044547388 [0,1,0,0,0,0|3,0,0]=4 769 B6R0.1 COCC(O)CN MCULE-2145726384 [0,1,0,0,0,0|3,0,0]=4 770 B6R0.1 COCC(O)CN MCULE-3637597204 [0,1,0,0,0,0|3,0,0]=4 771 B6R0.1 COCC(O)CO MCULE-1154104224 [0,1,0,0,0,0|2,0,0]=3 772 B6R0.1 COC[C@@H](N)CO MCULE-2792470078 [0,1,0,0,0,0|2,0,0]=3 773 B6R0.1 COC[C@@H](N)CO MCULE-3805343572 [0,1,0,0,0,0|2,0,0]=3 774 B6R0.1 COC[C@@H](N)CO MCULE-7953239910 [0,1,0,0,0,0|2,0,0]=3 775 B6R0.1 COC[C@@H](N)CO MCULE-9178553914 [0,1,0,0,0,0|2,0,0]=3 776 B6R0.1 COC[C@@H](O)CN MCULE-2116679841 [0,1,0,0,0,0|3,0,0]=4 777 B6R0.1 COC[C@@H](O)CN MCULE-4198842123 [0,1,0,0,0,0|3,0,0]=4 778 B6R0.1 COC[C@@H](O)CN MCULE-6330998296 [0,1,0,0,0,0|3,0,0]=4 779 B6R0.1 COC[C@H](C)CO MCULE-3120475252 [0,1,0,0,0,0|2,0,0]=3 780 B6R0.1 COC[C@H](F)CN MCULE-2663238018 [0,1,0,0,0,0|3,0,0]=4 781 B6R0.1 COC[C@H](N)CO MCULE-1678153673 [0,1,0,0,0,0|2,0,0]=3 782 B6R0.1 COC[C@H](N)CO MCULE-2304967280 [0,1,0,0,0,0|2,0,0]=3 783 B6R0.1 COC[C@H](N)CO MCULE-6509090198 [0,1,0,0,0,0|2,0,0]=3 784 B6R0.1 COC[C@H](N)CO MCULE-9806530206 [0,1,0,0,0,0|2,0,0]=3 785 B6R0.1 COC[C@H](O)CN MCULE-1962346446 [0,1,0,0,0,0|3,0,0]=4 786 B6R0.1 COC[C@H](O)CN MCULE-6290984425 [0,1,0,0,0,0|3,0,0]=4 787 B6R0.1 CON(C)CCN MCULE-9318319159 [0,1,0,0,0,0|3,0,0]=4 788 B6R0.1 CSC(C)CCN MCULE-5474458753 [0,1,0,0,0,0|3,0,0]=4 789 B6R0.1 CSC(C)CCO MCULE-4317600086 [0,1,0,0,0,0|2,0,0]=3 790 B6R0.1 CSCC(C)CN MCULE-4493405290 [0,1,0,0,0,0|3,0,0]=4 791 B6R0.1 CSCC(C)CO MCULE-3842820579 [0,1,0,0,0,0|2,0,0]=3 792 B6R0.1 CSCC(O)CO MCULE-6573013078 [0,1,0,0,0,0|2,0,0]=3 793 B6R0.1 C[C@@H](CO)CCN MCULE-4422620011 [0,1,0,0,0,0|2,0,0]=3 794 B6R0.1 C[C@@H](CO)CCN MCULE-7560169391 [0,1,0,0,0,0|2,0,0]=3 795 B6R0.1 C[C@@H](CO)CCO MCULE-6545491289 [0,1,0,0,0,0|2,0,0]=3 796 B6R0.1 C[C@H](CO)CCO MCULE-2543010074 [0,1,0,0,0,0|2,0,0]=3 797 B6R0.1 C[C@H](CO)CCO MCULE-6036462418 [0,1,0,0,0,0|2,0,0]=3 798 B6R0.1 ClCC(Cl)CCBr MCULE-2469656567 [0,1,0,0,0,0|3,0,0]=4 799 B6R0.1 FC(CBr)CCBr MCULE-2311323533 [0,1,0,0,0,0|3,0,0]=4 800 B6R0.1 N/C(=N\O)/CCO MCULE-1794050637 [0,1,0,0,0,0|3,0,0]=4 801 B6R0.1 NC(CO)CCF MCULE-3691993352 [0,1,0,0,0,0|2,0,0]=3 802 B6R0.1 NC(CO)CCO MCULE-3703088648 [0,1,0,0,0,0|2,0,0]=3 803 B6R0.1 NC(CO)CCO MCULE-7609576462 [0,1,0,0,0,0|2,0,0]=3 804 B6R0.1 NCC(N)CCO MCULE-2965554481 [0,1,0,0,0,0|2,0,0]=3 805 B6R0.1 NCCC(=O)CN MCULE-3906468943 [0,1,0,0,0,0|3,0,0]=4 806 B6R0.1 NCCC(=O)CN MCULE-9593243702 [0,1,0,0,0,0|3,0,0]=4 807 B6R0.1 NCCC(F)CN MCULE-9478589176 [0,1,0,0,0,0|3,0,0]=4 808 B6R0.1 NCCC(O)CN MCULE-9177974477 [0,1,0,0,0,0|3,0,0]=4 809 B6R0.1 NCCC(O)CO MCULE-2556586168 [0,1,0,0,0,0|2,0,0]=3 810 B6R0.1 NNC(=O)CCO MCULE-6184351353 [0,1,0,0,0,0|3,0,0]=4 811 B6R0.1 N[C@@H](CO)CCO MCULE-4583236919 [0,1,0,0,0,0|2,0,0]=3 812 B6R0.1 N[C@@H](CO)CCO MCULE-5489716742 [0,1,0,0,0,0|2,0,0]=3 813 B6R0.1 N[C@H](CO)CCO MCULE-5338659573 [0,1,0,0,0,0|2,0,0]=3 814 B6R0.1 N[C@H](CO)CCO MCULE-8998003003 [0,1,0,0,0,0|2,0,0]=3 815 B6R0.1 N[C@H](CS)CCS MCULE-5846021725 [0,1,0,0,0,0|2,1,0]=4 816 B6R0.1 N[C@H](CS)CCS MCULE-6871313350 [0,1,0,0,0,0|2,1,0]=4 817 B6R0.1 N[C@H](CS)CCS MCULE-8095554848 [0,1,0,0,0,0|2,1,0]=4 818 B6R0.1 N[C@H](CS)CCS MCULE-8177349504 [0,1,0,0,0,0|2,1,0]=4 819 B6R0.1 O=C(CCl)CCCl MCULE-6460902474 [0,1,0,0,0,0|3,0,0]=4 820 B6R0.1 O=C(CCl)NCO MCULE-9960585064 [0,1,0,0,0,0|3,0,0]=4 821 B6R0.1 OC(CBr)CCBr MCULE-5156583342 [0,1,0,0,0,0|3,0,0]=4 822 B6R0.1 OC(CCl)CCCl MCULE-5495327725 [0,1,0,0,0,0|3,0,0]=4 823 B6R0.1 OCCC(O)CCl MCULE-4752952606 [0,1,0,0,0,0|2,0,0]=3 824 B6R0.1 OCCC(O)CO MCULE-6470178852 [0,1,0,0,0,0|2,0,0]=3 825 B6R0.1 OCC[C@@H](Br)CO MCULE-4859199629 [0,1,0,0,0,0|2,0,0]=3 826 B6R0.1 OCC[C@@H](O)CO MCULE-2312093276 [0,1,0,0,0,0|2,0,0]=3 827 B6R0.1 OCC[C@@H](O)CO MCULE-4636748782 [0,1,0,0,0,0|2,0,0]=3 828 B6R0.1 OCC[C@H](O)CBr MCULE-1990035925 [0,1,0,0,0,0|2,0,0]=3 829 B6R0.1 OCC[C@H](O)CCl MCULE-4561806159 [0,1,0,0,0,0|2,0,0]=3 830 B6R0.1 OCC[C@H](O)CCl MCULE-8582759529 [0,1,0,0,0,0|2,0,0]=3 831 B6R0.1 OCC[C@H](O)CO MCULE-2265914374 [0,1,0,0,0,0|2,0,0]=3 832 B6R0.1 OCC[C@H](O)CO MCULE-5459838421 [0,1,0,0,0,0|2,0,0]=3 833 B6R0.1 O[C@@H](CBr)CCBr MCULE-2137750043 [0,1,0,0,0,0|3,0,0]=4 834 B6R0.1 O[C@H](CBr)CCBr MCULE-2647046297 [0,1,0,0,0,0|3,0,0]=4 835 B6R0.1 O[C@H](CBr)CCBr MCULE-5662911918 [0,1,0,0,0,0|3,0,0]=4 836 B6R0.1 [C@@H](N)(CC)CC#N MCULE-3832898190 [0,1,0,0,0,0|2,0,1]=4 837 B6R0.1 [C@H](N)(CC)CC#N MCULE-3962570164 [0,1,0,0,0,0|2,0,1]=4 838 B6R0.1 [NH3+]CCC(F)C[NH3+] MCULE-8320233584 [0,1,0,0,0,0|3,0,0]=4 839 B6R0.4 C#CCCC(C)C MCULE-9613694830 [0,1,0,0,0,0|2,0,1]=4 840 B6R0.4 C#CCCC(C)O MCULE-1476308263 [0,1,0,0,0,0|1,0,2]=4 841 B6R0.4 C#CCNC(C)C MCULE-6517958599 [0,1,0,0,0,0|2,0,1]=4 842 B6R0.4 C#CCNC(C)C MCULE-7459223609 [0,1,0,0,0,0|2,0,1]=4 843 B6R0.4 C#CCOC(=O)C MCULE-5002994323 [0,1,0,0,0,0|1,0,2]=4 844 B6R0.4 C#CCOC(C)C MCULE-3111253071 [0,1,0,0,0,0|1,0,1]=3 845 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [0,1,0,0,0,0|1,0,2]=4 846 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [0,1,0,0,0,0|2,0,1]=4 847 B6R0.4 C=C(C)CCCC MCULE-1010177756 [0,1,0,0,0,0|2,0,1]=4 848 B6R0.4 C=C(C)CCCO MCULE-4629274490 [0,1,0,0,0,0|1,0,1]=3 849 B6R0.4 C=C(C)CNCC MCULE-2237759977 [0,1,0,0,0,0|2,0,1]=4 850 B6R0.4 C=C(F)CCCO MCULE-1688645687 [0,1,0,0,0,0|1,0,2]=4 851 B6R0.4 C=CCCC(C)Br MCULE-5841356762 [0,1,0,0,0,0|2,0,1]=4 852 B6R0.4 C=CCCC(C)C MCULE-7128249655 [0,1,0,0,0,0|2,0,1]=4 853 B6R0.4 C=CCCC(C)O MCULE-3388106789 [0,1,0,0,0,0|1,0,2]=4 854 B6R0.4 C=CCC[C@@H](C)O MCULE-1272820385 [0,1,0,0,0,0|1,0,2]=4 855 B6R0.4 C=CCC[C@@H](C)O MCULE-8509867177 [0,1,0,0,0,0|1,0,2]=4 856 B6R0.4 C=CCC[C@H](C)O MCULE-4371391667 [0,1,0,0,0,0|1,0,2]=4 857 B6R0.4 C=CCNC(C)C MCULE-1450045891 [0,1,0,0,0,0|2,0,1]=4 858 B6R0.4 C=CCNC(C)C MCULE-3261189096 [0,1,0,0,0,0|2,0,1]=4 859 B6R0.4 C=CCNC(C)C MCULE-4894255968 [0,1,0,0,0,0|2,0,1]=4 860 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [0,1,0,0,0,0|1,0,2]=4 861 B6R0.4 C=COCC(C)C MCULE-7268141053 [0,1,0,0,0,0|1,0,2]=4 862 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [0,1,0,0,0,0|1,0,2]=4 863 B6R0.4 CC(=CCCBr)C MCULE-9403575147 [0,1,0,0,0,0|2,0,1]=4 864 B6R0.4 CC(=CCCN)C MCULE-9185531904 [0,1,0,0,0,0|2,0,1]=4 865 B6R0.4 CC(=CCCO)C MCULE-2493404466 [0,1,0,0,0,0|1,0,1]=3 866 B6R0.4 CC(=CCCO)C MCULE-8497528596 [0,1,0,0,0,0|1,0,1]=3 867 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [0,1,0,0,0,0|2,0,1]=4 868 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [0,1,0,0,0,0|2,0,1]=4 869 B6R0.4 CC(=O)CCCO MCULE-1335342150 [0,1,0,0,0,0|1,0,1]=3 870 B6R0.4 CC(=O)NCCCl MCULE-7865062188 [0,1,0,0,0,0|2,0,1]=4 871 B6R0.4 CC(=O)NCCN MCULE-2230084818 [0,1,0,0,0,0|2,0,1]=4 872 B6R0.4 CC(=O)NCCO MCULE-5968518415 [0,1,0,0,0,0|1,0,1]=3 873 B6R0.4 CC(=O)NCCS MCULE-3345813615 [0,1,0,0,0,0|1,1,1]=4 874 B6R0.4 CC(=O)OCC#N MCULE-4866082576 [0,1,0,0,0,0|1,0,2]=4 875 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [0,1,0,0,0,0|1,0,1]=3 876 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [0,1,0,0,0,0|1,0,1]=3 877 B6R0.4 CC(=O)OCCN MCULE-4530529900 [0,1,0,0,0,0|1,0,1]=3 878 B6R0.4 CC(=O)OCCN MCULE-6854340494 [0,1,0,0,0,0|1,0,1]=3 879 B6R0.4 CC(=O)OCCO MCULE-1251660436 [0,1,0,0,0,0|0,0,1]=2 880 B6R0.4 CC(=O)SCCBr MCULE-1786480878 [0,1,0,0,0,0|1,1,1]=4 881 B6R0.4 CC(=O)SCCN MCULE-3819903256 [0,1,0,0,0,0|1,1,1]=4 882 B6R0.4 CC(=O)SCCN MCULE-4872130470 [0,1,0,0,0,0|1,1,1]=4 883 B6R0.4 CC(=O)SCCN MCULE-7084821345 [0,1,0,0,0,0|1,1,1]=4 884 B6R0.4 CC(Br)CCC#N MCULE-7424967519 [0,1,0,0,0,0|2,0,1]=4 885 B6R0.4 CC(Br)CCCBr MCULE-8808667049 [0,1,0,0,0,0|2,0,0]=3 886 B6R0.4 CC(C)C=CCBr MCULE-9812152361 [0,1,0,0,0,0|2,0,1]=4 887 B6R0.4 CC(C)CCC#N MCULE-5503038837 [0,1,0,0,0,0|2,0,1]=4 888 B6R0.4 CC(C)CCC=O MCULE-9664145623 [0,1,0,0,0,0|1,0,2]=4 889 B6R0.4 CC(C)CCCBr MCULE-2045625937 [0,1,0,0,0,0|2,0,0]=3 890 B6R0.4 CC(C)CCCCl MCULE-4841628592 [0,1,0,0,0,0|2,0,0]=3 891 B6R0.4 CC(C)CCCI MCULE-4035616717 [0,1,0,0,0,0|2,0,0]=3 892 B6R0.4 CC(C)CCCN MCULE-2232715676 [0,1,0,0,0,0|2,0,0]=3 893 B6R0.4 CC(C)CCCN MCULE-7121372197 [0,1,0,0,0,0|2,0,0]=3 894 B6R0.4 CC(C)CCCO MCULE-5797993948 [0,1,0,0,0,0|1,0,0]=2 895 B6R0.4 CC(C)CCCS MCULE-8417191578 [0,1,0,0,0,0|1,1,0]=3 896 B6R0.4 CC(C)CCNN MCULE-1163630283 [0,1,0,0,0,0|3,0,0]=4 897 B6R0.4 CC(C)CCNN MCULE-2023326468 [0,1,0,0,0,0|3,0,0]=4 898 B6R0.4 CC(C)CCNN MCULE-4572239737 [0,1,0,0,0,0|3,0,0]=4 899 B6R0.4 CC(C)CCON MCULE-2653553816 [0,1,0,0,0,0|3,0,0]=4 900 B6R0.4 CC(C)CCON MCULE-6468395078 [0,1,0,0,0,0|3,0,0]=4 901 B6R0.4 CC(C)COC=O MCULE-8234906771 [0,1,0,0,0,0|2,0,1]=4 902 B6R0.4 CC(C)COCCl MCULE-2194640169 [0,1,0,0,0,0|2,0,0]=3 903 B6R0.4 CC(C)CON=O MCULE-8394966903 [0,1,0,0,0,0|3,0,0]=4 904 B6R0.4 CC(C)CSCCl MCULE-5218455619 [0,1,0,0,0,0|2,1,0]=4 905 B6R0.4 CC(C)NCC#N MCULE-1545752174 [0,1,0,0,0,0|2,0,1]=4 906 B6R0.4 CC(C)NCC#N MCULE-4381172074 [0,1,0,0,0,0|2,0,1]=4 907 B6R0.4 CC(C)NCCCl MCULE-1521398137 [0,1,0,0,0,0|2,0,0]=3 908 B6R0.4 CC(C)NCCCl MCULE-2586914937 [0,1,0,0,0,0|2,0,0]=3 909 B6R0.4 CC(C)NCCN MCULE-1003086359 [0,1,0,0,0,0|2,0,0]=3 910 B6R0.4 CC(C)NCCN MCULE-5066931507 [0,1,0,0,0,0|2,0,0]=3 911 B6R0.4 CC(C)NCCO MCULE-1749029105 [0,1,0,0,0,0|1,0,0]=2 912 B6R0.4 CC(C)OCC#N MCULE-4594795380 [0,1,0,0,0,0|1,0,1]=3 913 B6R0.4 CC(C)OCC=O MCULE-5974054323 [0,1,0,0,0,0|0,0,2]=3 914 B6R0.4 CC(C)OCCBr MCULE-8869065375 [0,1,0,0,0,0|1,0,0]=2 915 B6R0.4 CC(C)OCCCl MCULE-3848763715 [0,1,0,0,0,0|1,0,0]=2 916 B6R0.4 CC(C)OCCI MCULE-8259612531 [0,1,0,0,0,0|1,0,0]=2 917 B6R0.4 CC(C)OCCN MCULE-6140628944 [0,1,0,0,0,0|1,0,0]=2 918 B6R0.4 CC(C)OCCN MCULE-7438591135 [0,1,0,0,0,0|1,0,0]=2 919 B6R0.4 CC(C)OCCN MCULE-7614115649 [0,1,0,0,0,0|1,0,0]=2 920 B6R0.4 CC(C)OCCO MCULE-8766149613 [0,1,0,0,0,0|0,0,0]=1 921 B6R0.4 CC(C)SCC#N MCULE-2685282403 [0,1,0,0,0,0|1,1,1]=4 922 B6R0.4 CC(C)SCC=O MCULE-3174965592 [0,1,0,0,0,0|0,1,2]=4 923 B6R0.4 CC(C)SCCCl MCULE-4991548042 [0,1,0,0,0,0|1,1,0]=3 924 B6R0.4 CC(C)SCCN MCULE-2838203545 [0,1,0,0,0,0|1,1,0]=3 925 B6R0.4 CC(C)SCCN MCULE-6551225219 [0,1,0,0,0,0|1,1,0]=3 926 B6R0.4 CC(C)SCCO MCULE-1467015400 [0,1,0,0,0,0|0,1,0]=2 927 B6R0.4 CC(Cl)CCC#N MCULE-2064174419 [0,1,0,0,0,0|2,0,1]=4 928 B6R0.4 CC(Cl)CCCCl MCULE-9382073752 [0,1,0,0,0,0|2,0,0]=3 929 B6R0.4 CC(Cl)CCCO MCULE-2554250532 [0,1,0,0,0,0|1,0,0]=2 930 B6R0.4 CC(N)CCCN MCULE-4857113826 [0,1,0,0,0,0|2,0,0]=3 931 B6R0.4 CC(N)CCCN MCULE-4899798325 [0,1,0,0,0,0|2,0,0]=3 932 B6R0.4 CC(N)CCCO MCULE-6629535696 [0,1,0,0,0,0|1,0,0]=2 933 B6R0.4 CC(O)CCC#N MCULE-6350143710 [0,1,0,0,0,0|2,0,1]=4 934 B6R0.4 CC(O)CCCBr MCULE-5477662754 [0,1,0,0,0,0|2,0,0]=3 935 B6R0.4 CC(O)CCCCl MCULE-6993728810 [0,1,0,0,0,0|2,0,0]=3 936 B6R0.4 CC(O)CCCN MCULE-3754805134 [0,1,0,0,0,0|2,0,0]=3 937 B6R0.4 CC(O)CCCO MCULE-6580326052 [0,1,0,0,0,0|1,0,0]=2 938 B6R0.4 CC(O)CN=N#N MCULE-3020215858 [0,1,0,0,0,0|3,0,0]=4 939 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [0,1,0,0,0,0|1,0,2]=4 940 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [0,1,0,0,0,0|1,0,2]=4 941 B6R0.4 CC=CCC(C)C MCULE-7145682250 [0,1,0,0,0,0|2,0,1]=4 942 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [0,1,0,0,0,0|1,0,2]=4 943 B6R0.4 CCC#CC(C)O MCULE-6395334377 [0,1,0,0,0,0|1,0,1]=3 944 B6R0.4 CCC=CB(O)O MCULE-6166989227 [0,1,0,0,0,0|2,0,1]=4 945 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [0,1,0,0,0,0|1,0,2]=4 946 B6R0.4 CCCC=C(C)C MCULE-2110588796 [0,1,0,0,0,0|2,0,1]=4 947 B6R0.4 CCCCB(O)O MCULE-9002672645 [0,1,0,0,0,0|2,0,0]=3 948 B6R0.4 CCCCC(=N)N MCULE-3271993509 [0,1,0,0,0,0|2,0,1]=4 949 B6R0.4 CCCCC(=N)N MCULE-3935017760 [0,1,0,0,0,0|2,0,1]=4 950 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [0,1,0,0,0,0|1,0,2]=4 951 B6R0.4 CCCCC(=O)C MCULE-3554390184 [0,1,0,0,0,0|1,0,2]=4 952 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [0,1,0,0,0,0|1,0,2]=4 953 B6R0.4 CCCCC(=O)N MCULE-6419483436 [0,1,0,0,0,0|1,0,2]=4 954 B6R0.4 CCCCC(=O)O MCULE-2333640078 [0,1,0,0,0,0|1,0,1]=3 955 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [0,1,0,0,0,0|1,0,2]=4 956 B6R0.4 CCCCC(=S)N MCULE-8236760762 [0,1,0,0,0,0|1,1,1]=4 957 B6R0.4 CCCCC(C)Br MCULE-3252474574 [0,1,0,0,0,0|2,0,0]=3 958 B6R0.4 CCCCC(C)C MCULE-7568461039 [0,1,0,0,0,0|2,0,0]=3 959 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [0,1,0,0,0,0|2,0,0]=3 960 B6R0.4 CCCCC(C)N MCULE-5349371506 [0,1,0,0,0,0|2,0,0]=3 961 B6R0.4 CCCCC(C)N MCULE-6696490028 [0,1,0,0,0,0|2,0,0]=3 962 B6R0.4 CCCCC(C)O MCULE-6558228722 [0,1,0,0,0,0|1,0,0]=2 963 B6R0.4 CCCCC(C)S MCULE-4791681848 [0,1,0,0,0,0|1,1,0]=3 964 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [0,1,0,0,0,0|2,0,1]=4 965 B6R0.4 CCCCN(C)C MCULE-7202077639 [0,1,0,0,0,0|3,0,0]=4 966 B6R0.4 CCCCN(C)N MCULE-7927159797 [0,1,0,0,0,0|3,0,0]=4 967 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [0,1,0,0,0,0|2,0,1]=4 968 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [0,1,0,0,0,0|2,0,1]=4 969 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [0,1,0,0,0,0|2,0,0]=3 970 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [0,1,0,0,0,0|2,0,0]=3 971 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [0,1,0,0,0,0|1,0,0]=2 972 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [0,1,0,0,0,0|1,0,0]=2 973 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [0,1,0,0,0,0|2,0,0]=3 974 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [0,1,0,0,0,0|2,0,0]=3 975 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [0,1,0,0,0,0|1,0,0]=2 976 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [0,1,0,0,0,0|1,0,0]=2 977 B6R0.4 CCCNC(=O)C MCULE-5899703886 [0,1,0,0,0,0|2,0,1]=4 978 B6R0.4 CCCNC(C)C MCULE-7475023734 [0,1,0,0,0,0|2,0,0]=3 979 B6R0.4 CCCOC(=O)C MCULE-7327042566 [0,1,0,0,0,0|1,0,1]=3 980 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [0,1,0,0,0,0|2,0,1]=4 981 B6R0.4 CCCOC(=O)N MCULE-2760622567 [0,1,0,0,0,0|2,0,1]=4 982 B6R0.4 CCCOC(=S)[S-] MCULE-9126934993 [0,1,0,0,0,0|2,0,1]=4 983 B6R0.4 CCCOC(=S)[S-] MCULE-9566804941 [0,1,0,0,0,0|2,0,1]=4 984 B6R0.4 CCCON(=O)=O MCULE-3372904250 [0,1,0,0,0,0|3,0,0]=4 985 B6R0.4 CCCSC(=O)C MCULE-4329646671 [0,1,0,0,0,0|1,1,1]=4 986 B6R0.4 CCCSC(C)C MCULE-2233656285 [0,1,0,0,0,0|1,1,0]=3 987 B6R0.4 CCN=CC(C)C MCULE-7306741362 [0,1,0,0,0,0|2,0,1]=4 988 B6R0.4 CCNCC(=O)C MCULE-5799315547 [0,1,0,0,0,0|1,0,2]=4 989 B6R0.4 CCNCC(=O)C MCULE-9258294157 [0,1,0,0,0,0|1,0,2]=4 990 B6R0.4 CCNCC(=O)N MCULE-1787248899 [0,1,0,0,0,0|1,0,2]=4 991 B6R0.4 CCNCC(=O)N MCULE-3821700273 [0,1,0,0,0,0|1,0,2]=4 992 B6R0.4 CCNCC(=O)O MCULE-5989480216 [0,1,0,0,0,0|1,0,1]=3 993 B6R0.4 CCNCC(=O)O MCULE-8087863397 [0,1,0,0,0,0|1,0,1]=3 994 B6R0.4 CCNCC(C)C MCULE-1625905125 [0,1,0,0,0,0|2,0,0]=3 995 B6R0.4 CCNCC(C)C MCULE-3527739859 [0,1,0,0,0,0|2,0,0]=3 996 B6R0.4 CCNCC(C)O MCULE-5078068369 [0,1,0,0,0,0|1,0,0]=2 997 B6R0.4 CCNCC(F)F MCULE-3324117157 [0,1,0,0,0,0|2,0,0]=3 998 B6R0.4 CCNCC(F)F MCULE-7919972639 [0,1,0,0,0,0|2,0,0]=3 999 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [0,1,0,0,0,0|1,0,0]=2 1000 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [0,1,0,0,0,0|1,0,0]=2 1001 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [0,1,0,0,0,0|1,0,0]=2 1002 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [0,1,0,0,0,0|1,0,0]=2 1003 B6R0.4 CCOCC(=N)N MCULE-3232806707 [0,1,0,0,0,0|1,0,1]=3 1004 B6R0.4 CCOCC(=N)N MCULE-4996987536 [0,1,0,0,0,0|1,0,1]=3 1005 B6R0.4 CCOCC(=O)C MCULE-2825677443 [0,1,0,0,0,0|0,0,2]=3 1006 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [0,1,0,0,0,0|0,0,2]=3 1007 B6R0.4 CCOCC(=O)O MCULE-1726530898 [0,1,0,0,0,0|0,0,1]=2 1008 B6R0.4 CCOCC(=S)N MCULE-7064672670 [0,1,0,0,0,0|0,1,1]=3 1009 B6R0.4 CCOCC(C)C MCULE-7986128672 [0,1,0,0,0,0|1,0,0]=2 1010 B6R0.4 CCOCC(C)N MCULE-8540668261 [0,1,0,0,0,0|1,0,0]=2 1011 B6R0.4 CCOCC(C)N MCULE-8720228996 [0,1,0,0,0,0|1,0,0]=2 1012 B6R0.4 CCOCC(C)O MCULE-6224339526 [0,1,0,0,0,0|0,0,0]=1 1013 B6R0.4 CCOC[C@@H](C)N MCULE-7053460047 [0,1,0,0,0,0|1,0,0]=2 1014 B6R0.4 CCOC[C@@H](C)N MCULE-9865800502 [0,1,0,0,0,0|1,0,0]=2 1015 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [0,1,0,0,0,0|0,0,0]=1 1016 B6R0.4 CCOC[C@H](C)N MCULE-2897416804 [0,1,0,0,0,0|1,0,0]=2 1017 B6R0.4 CCOC[C@H](C)N MCULE-6799267946 [0,1,0,0,0,0|1,0,0]=2 1018 B6R0.4 CCONC(C)C MCULE-2412572743 [0,1,0,0,0,0|2,0,0]=3 1019 B6R0.4 CCONC(C)C MCULE-9246196365 [0,1,0,0,0,0|2,0,0]=3 1020 B6R0.4 CCSCC(=O)C MCULE-9872082780 [0,1,0,0,0,0|0,1,2]=4 1021 B6R0.4 CCSCC(=O)O MCULE-7471335718 [0,1,0,0,0,0|0,1,1]=3 1022 B6R0.4 CCSCC(C)N MCULE-3399255190 [0,1,0,0,0,0|1,1,0]=3 1023 B6R0.4 CN(C)CCCBr MCULE-2862944726 [0,1,0,0,0,0|3,0,0]=4 1024 B6R0.4 CN(C)CCCBr MCULE-4596026048 [0,1,0,0,0,0|3,0,0]=4 1025 B6R0.4 CN(C)CCCBr MCULE-7515880350 [0,1,0,0,0,0|3,0,0]=4 1026 B6R0.4 CN(C)CCCCl MCULE-1347366200 [0,1,0,0,0,0|3,0,0]=4 1027 B6R0.4 CN(C)CCCCl MCULE-3767329555 [0,1,0,0,0,0|3,0,0]=4 1028 B6R0.4 CN(C)CCCI MCULE-2134226049 [0,1,0,0,0,0|3,0,0]=4 1029 B6R0.4 CN(C)CCCI MCULE-2999516061 [0,1,0,0,0,0|3,0,0]=4 1030 B6R0.4 CN(C)CCCN MCULE-3882436382 [0,1,0,0,0,0|3,0,0]=4 1031 B6R0.4 CN(C)CCCN MCULE-4415270662 [0,1,0,0,0,0|3,0,0]=4 1032 B6R0.4 CN(C)CCCN MCULE-4624916051 [0,1,0,0,0,0|3,0,0]=4 1033 B6R0.4 CN(C)CCCN MCULE-4749435878 [0,1,0,0,0,0|3,0,0]=4 1034 B6R0.4 CN(C)CCCN MCULE-9301668058 [0,1,0,0,0,0|3,0,0]=4 1035 B6R0.4 CN(C)CCCO MCULE-7408728427 [0,1,0,0,0,0|2,0,0]=3 1036 B6R0.4 CN(C)CCCS MCULE-7945161812 [0,1,0,0,0,0|2,1,0]=4 1037 B6R0.4 CN(C)NCCCl MCULE-2462354397 [0,1,0,0,0,0|3,0,0]=4 1038 B6R0.4 CN(C)NCCCl MCULE-7933853049 [0,1,0,0,0,0|3,0,0]=4 1039 B6R0.4 CNCCC(=O)O MCULE-3627988097 [0,1,0,0,0,0|2,0,1]=4 1040 B6R0.4 CNCCC(=O)O MCULE-9858204248 [0,1,0,0,0,0|2,0,1]=4 1041 B6R0.4 CNCCC(C)C MCULE-3679914556 [0,1,0,0,0,0|3,0,0]=4 1042 B6R0.4 CNCCC(C)C MCULE-9679972004 [0,1,0,0,0,0|3,0,0]=4 1043 B6R0.4 CNCCC(C)N MCULE-5955505029 [0,1,0,0,0,0|3,0,0]=4 1044 B6R0.4 CNCCC(C)N MCULE-8933967952 [0,1,0,0,0,0|3,0,0]=4 1045 B6R0.4 CNCCC(C)O MCULE-1615526002 [0,1,0,0,0,0|2,0,0]=3 1046 B6R0.4 CNCC[C@@H](C)N MCULE-6024494304 [0,1,0,0,0,0|3,0,0]=4 1047 B6R0.4 CNCC[C@H](C)N MCULE-5449372796 [0,1,0,0,0,0|3,0,0]=4 1048 B6R0.4 CNCC[C@H](C)N MCULE-8157402351 [0,1,0,0,0,0|3,0,0]=4 1049 B6R0.4 CNOCC(C)C MCULE-4779196887 [0,1,0,0,0,0|2,0,0]=3 1050 B6R0.4 CNOCC(C)C MCULE-7320343096 [0,1,0,0,0,0|2,0,0]=3 1051 B6R0.4 COCCC(=O)O MCULE-3436347115 [0,1,0,0,0,0|2,0,1]=4 1052 B6R0.4 COCCC(C)Br MCULE-6529807745 [0,1,0,0,0,0|3,0,0]=4 1053 B6R0.4 COCCC(C)C MCULE-8727768886 [0,1,0,0,0,0|3,0,0]=4 1054 B6R0.4 COCCC(C)N MCULE-6183216923 [0,1,0,0,0,0|3,0,0]=4 1055 B6R0.4 COCCC(C)O MCULE-6536001437 [0,1,0,0,0,0|2,0,0]=3 1056 B6R0.4 COCC[C@H](C)N MCULE-6163336851 [0,1,0,0,0,0|3,0,0]=4 1057 B6R0.4 COCC[C@H](C)N MCULE-6363449253 [0,1,0,0,0,0|3,0,0]=4 1058 B6R0.4 COCOC(=O)C MCULE-8876091916 [0,1,0,0,0,0|2,0,1]=4 1059 B6R0.4 CS(=O)CCCN MCULE-1124989526 [0,1,0,0,0,0|3,0,0]=4 1060 B6R0.4 CS(=O)CCCN MCULE-8758903495 [0,1,0,0,0,0|3,0,0]=4 1061 B6R0.4 CSCCC(=O)O MCULE-9550032941 [0,1,0,0,0,0|2,0,1]=4 1062 B6R0.4 CSCCC(C)N MCULE-3925048385 [0,1,0,0,0,0|3,0,0]=4 1063 B6R0.4 CSCCC(C)O MCULE-5934844952 [0,1,0,0,0,0|2,0,0]=3 1064 B6R0.4 CSCOC(=O)C MCULE-1498769347 [0,1,0,0,0,0|2,0,1]=4 1065 B6R0.4 CSSCC(=O)O MCULE-5829510166 [0,1,0,0,0,0|1,1,1]=4 1066 B6R0.4 C[C@@H](N)CCCO MCULE-8313291415 [0,1,0,0,0,0|1,0,0]=2 1067 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [0,1,0,0,0,0|1,0,0]=2 1068 B6R0.4 FC(F)CCCBr MCULE-1364730558 [0,1,0,0,0,0|3,0,0]=4 1069 B6R0.4 FC(F)COCCl MCULE-4986204241 [0,1,0,0,0,0|2,0,0]=3 1070 B6R0.4 FC(F)OCCBr MCULE-8028905013 [0,1,0,0,0,0|2,0,0]=3 1071 B6R0.4 N=C(N)NCCO MCULE-5114367892 [0,1,0,0,0,0|2,0,1]=4 1072 B6R0.4 N=C(N)NCCO MCULE-6389092248 [0,1,0,0,0,0|2,0,1]=4 1073 B6R0.4 N=C(N)SCCO MCULE-5563309692 [0,1,0,0,0,0|1,1,1]=4 1074 B6R0.4 N=C(N)SCCO MCULE-5671847690 [0,1,0,0,0,0|1,1,1]=4 1075 B6R0.4 NC(=NCCO)N MCULE-5043697998 [0,1,0,0,0,0|2,0,1]=4 1076 B6R0.4 NC(=O)CCCO MCULE-3779341561 [0,1,0,0,0,0|2,0,1]=4 1077 B6R0.4 NC(=O)NCCO MCULE-2353513655 [0,1,0,0,0,0|2,0,1]=4 1078 B6R0.4 NC(=O)OCCCl MCULE-4259077420 [0,1,0,0,0,0|2,0,1]=4 1079 B6R0.4 NC(=O)OCCO MCULE-7565460845 [0,1,0,0,0,0|1,0,1]=3 1080 B6R0.4 NC(=S)CCCO MCULE-8951145487 [0,1,0,0,0,0|2,0,1]=4 1081 B6R0.4 NC(=S)NCCO MCULE-9343742573 [0,1,0,0,0,0|2,0,1]=4 1082 B6R0.4 NCCCC(=O)O MCULE-3615304273 [0,1,0,0,0,0|2,0,1]=4 1083 B6R0.4 NCCCC(=O)O MCULE-7613134021 [0,1,0,0,0,0|2,0,1]=4 1084 B6R0.4 NCCCC(F)F MCULE-3173114913 [0,1,0,0,0,0|3,0,0]=4 1085 B6R0.4 NCCCC(F)F MCULE-8441119601 [0,1,0,0,0,0|3,0,0]=4 1086 B6R0.4 NCCOC(=O)N MCULE-4144808257 [0,1,0,0,0,0|2,0,1]=4 1087 B6R0.4 NCCOC(=O)N MCULE-5815053840 [0,1,0,0,0,0|2,0,1]=4 1088 B6R0.4 NCCOC(F)F MCULE-4294860342 [0,1,0,0,0,0|2,0,0]=3 1089 B6R0.4 NCCOC(F)F MCULE-4957283927 [0,1,0,0,0,0|2,0,0]=3 1090 B6R0.4 NCCON(=O)=O MCULE-1660868950 [0,1,0,0,0,0|3,0,0]=4 1091 B6R0.4 NCCON(=O)=O MCULE-5781896981 [0,1,0,0,0,0|3,0,0]=4 1092 B6R0.4 O=C(Cl)OCCBr MCULE-6758010852 [0,1,0,0,0,0|2,0,1]=4 1093 B6R0.4 O=C(Cl)OCCCl MCULE-1505786385 [0,1,0,0,0,0|2,0,1]=4 1094 B6R0.4 O=C(Cl)OCCF MCULE-5233366139 [0,1,0,0,0,0|2,0,1]=4 1095 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [0,1,0,0,0,0|2,0,1]=4 1096 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [0,1,0,0,0,0|2,0,1]=4 1097 B6R0.4 O=C(O)CCCF MCULE-2415675768 [0,1,0,0,0,0|2,0,1]=4 1098 B6R0.4 O=C(O)CCCI MCULE-7794841553 [0,1,0,0,0,0|2,0,1]=4 1099 B6R0.4 O=C(O)CCCS MCULE-3352840152 [0,1,0,0,0,0|2,0,1]=4 1100 B6R0.4 O=C(O)CNCO MCULE-4092998319 [0,1,0,0,0,0|2,0,1]=4 1101 B6R0.4 O=N(=O)CCCO MCULE-5021681032 [0,1,0,0,0,0|3,0,0]=4 1102 B6R0.4 OCCCC(F)F MCULE-2972867290 [0,1,0,0,0,0|2,0,0]=3 1103 B6R0.4 OCCOC(F)F MCULE-6004830165 [0,1,0,0,0,0|1,0,0]=2 1104 B6R0.4 P(=O)([O-])OCCC MCULE-3877591764 [0,1,0,0,0,0|3,0,0]=4 1105 B6R0.6 BrCCCCCBr MCULE-7929769310 [0,1,0,0,0,0|2,0,0]=3 1106 B6R0.6 BrCCNCCBr MCULE-8656215402 [0,1,0,0,0,0|2,0,0]=3 1107 B6R0.6 BrCCOCCBr MCULE-7971589019 [0,1,0,0,0,0|1,0,0]=2 1108 B6R0.6 BrCCSCCBr MCULE-9680858393 [0,1,0,0,0,0|1,1,0]=3 1109 B6R0.6 BrCC[NH2+]CCBr MCULE-8263104784 [0,1,0,0,0,0|2,0,0]=3 1110 B6R0.6 C#CCCCCBr MCULE-9086746106 [0,1,0,0,0,0|2,0,1]=4 1111 B6R0.6 C#CCCCCC MCULE-7776756434 [0,1,0,0,0,0|2,0,0]=3 1112 B6R0.6 C#CCCCCCl MCULE-3718113550 [0,1,0,0,0,0|2,0,1]=4 1113 B6R0.6 C#CCCCCI MCULE-6799128140 [0,1,0,0,0,0|2,0,1]=4 1114 B6R0.6 C#CCCCCN MCULE-1313888655 [0,1,0,0,0,0|2,0,1]=4 1115 B6R0.6 C#CCCCCN MCULE-5521830994 [0,1,0,0,0,0|2,0,1]=4 1116 B6R0.6 C#CCCCCO MCULE-2977997146 [0,1,0,0,0,0|1,0,1]=3 1117 B6R0.6 C#CCCCNC MCULE-4472877921 [0,1,0,0,0,0|2,0,1]=4 1118 B6R0.6 C#CCCCNC MCULE-9185657315 [0,1,0,0,0,0|2,0,1]=4 1119 B6R0.6 C#CCCCOC MCULE-3174650949 [0,1,0,0,0,0|1,0,2]=4 1120 B6R0.6 C#CCCCON MCULE-5269610423 [0,1,0,0,0,0|1,0,2]=4 1121 B6R0.6 C#CCCSCC MCULE-1094584940 [0,1,0,0,0,0|1,1,0]=3 1122 B6R0.6 C#CCNCCC MCULE-7880884278 [0,1,0,0,0,0|2,0,1]=4 1123 B6R0.6 C#CCNCCC MCULE-8975069665 [0,1,0,0,0,0|2,0,1]=4 1124 B6R0.6 C#CCNCCF MCULE-4170618564 [0,1,0,0,0,0|2,0,1]=4 1125 B6R0.6 C#CCNCCF MCULE-9423438350 [0,1,0,0,0,0|2,0,1]=4 1126 B6R0.6 C#CCNCCO MCULE-4984192820 [0,1,0,0,0,0|1,0,1]=3 1127 B6R0.6 C#CCOCC#C MCULE-8251512824 [0,1,0,0,0,0|1,0,2]=4 1128 B6R0.6 C#CCOCCBr MCULE-5950372691 [0,1,0,0,0,0|1,0,1]=3 1129 B6R0.6 C#CCOCCI MCULE-1768726531 [0,1,0,0,0,0|1,0,1]=3 1130 B6R0.6 C#CCOCCN MCULE-3709649461 [0,1,0,0,0,0|1,0,1]=3 1131 B6R0.6 C#CCOCCN MCULE-5750437888 [0,1,0,0,0,0|1,0,1]=3 1132 B6R0.6 C#CCOCCO MCULE-4502913039 [0,1,0,0,0,0|0,0,1]=2 1133 B6R0.6 C#CCSCCN MCULE-2934790818 [0,1,0,0,0,0|1,1,1]=4 1134 B6R0.6 C#CCSCCN MCULE-8370704639 [0,1,0,0,0,0|1,1,1]=4 1135 B6R0.6 C#CCSCCO MCULE-6167723961 [0,1,0,0,0,0|0,1,1]=3 1136 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [0,1,0,0,0,0|1,0,1]=3 1137 B6R0.6 C/C=C/C=C/CO MCULE-3717958585 [0,1,0,0,0,0|1,0,2]=4 1138 B6R0.6 C/C=C/CCCC MCULE-6900331316 [0,1,0,0,0,0|2,0,1]=4 1139 B6R0.6 C/C=C/CCCO MCULE-9865436125 [0,1,0,0,0,0|1,0,1]=3 1140 B6R0.6 C/C=C\CCCC MCULE-8426867799 [0,1,0,0,0,0|2,0,1]=4 1141 B6R0.6 C/C=C\CCCO MCULE-3169839661 [0,1,0,0,0,0|1,0,1]=3 1142 B6R0.6 C=CC=CCCO MCULE-5956097722 [0,1,0,0,0,0|1,0,2]=4 1143 B6R0.6 C=CCC#CCO MCULE-2958886356 [0,1,0,0,0,0|1,0,2]=4 1144 B6R0.6 C=CCC/C=C/C MCULE-3936427871 [0,1,0,0,0,0|2,0,1]=4 1145 B6R0.6 C=CCCC=CC MCULE-6481809840 [0,1,0,0,0,0|2,0,1]=4 1146 B6R0.6 C=CCCCCBr MCULE-4313298656 [0,1,0,0,0,0|2,0,1]=4 1147 B6R0.6 C=CCCCCC MCULE-5868303078 [0,1,0,0,0,0|2,0,0]=3 1148 B6R0.6 C=CCCCCCl MCULE-7600727876 [0,1,0,0,0,0|2,0,1]=4 1149 B6R0.6 C=CCCCCI MCULE-5694143061 [0,1,0,0,0,0|2,0,1]=4 1150 B6R0.6 C=CCCCCN MCULE-1489231988 [0,1,0,0,0,0|2,0,1]=4 1151 B6R0.6 C=CCCCCN MCULE-4288584778 [0,1,0,0,0,0|2,0,1]=4 1152 B6R0.6 C=CCCCCO MCULE-3631432277 [0,1,0,0,0,0|1,0,1]=3 1153 B6R0.6 C=CCCCNC MCULE-6696525157 [0,1,0,0,0,0|2,0,1]=4 1154 B6R0.6 C=CCCCNC MCULE-7417274044 [0,1,0,0,0,0|2,0,1]=4 1155 B6R0.6 C=CCCCON MCULE-6496647420 [0,1,0,0,0,0|1,0,2]=4 1156 B6R0.6 C=CCCCON MCULE-7055713530 [0,1,0,0,0,0|1,0,2]=4 1157 B6R0.6 C=CCNCCC MCULE-4239068147 [0,1,0,0,0,0|2,0,1]=4 1158 B6R0.6 C=CCNCCC MCULE-9778489216 [0,1,0,0,0,0|2,0,1]=4 1159 B6R0.6 C=CCNCCO MCULE-5860509324 [0,1,0,0,0,0|1,0,1]=3 1160 B6R0.6 C=CCOCC=C MCULE-1121686176 [0,1,0,0,0,0|1,0,2]=4 1161 B6R0.6 C=CCOCC=O MCULE-8507800253 [0,1,0,0,0,0|0,0,3]=4 1162 B6R0.6 C=CCOCCBr MCULE-7565992230 [0,1,0,0,0,0|1,0,1]=3 1163 B6R0.6 C=CCOCCCl MCULE-1353236332 [0,1,0,0,0,0|1,0,1]=3 1164 B6R0.6 C=CCOCCI MCULE-8468439129 [0,1,0,0,0,0|1,0,1]=3 1165 B6R0.6 C=CCOCCN MCULE-5411259412 [0,1,0,0,0,0|1,0,1]=3 1166 B6R0.6 C=CCOCCN MCULE-9798285838 [0,1,0,0,0,0|1,0,1]=3 1167 B6R0.6 C=CCOCCO MCULE-5718868633 [0,1,0,0,0,0|0,0,1]=2 1168 B6R0.6 C=CCOCOC MCULE-6553342654 [0,1,0,0,0,0|1,0,1]=3 1169 B6R0.6 C=CCSCCC MCULE-3855352363 [0,1,0,0,0,0|1,1,1]=4 1170 B6R0.6 C=CCSCCN MCULE-3972995930 [0,1,0,0,0,0|1,1,1]=4 1171 B6R0.6 C=CCSCCN MCULE-9922932955 [0,1,0,0,0,0|1,1,1]=4 1172 B6R0.6 C=COCCCC MCULE-2025922328 [0,1,0,0,0,0|1,0,2]=4 1173 B6R0.6 C=COCCCN MCULE-1669664157 [0,1,0,0,0,0|1,0,2]=4 1174 B6R0.6 C=COCCCO MCULE-8325617945 [0,1,0,0,0,0|0,0,2]=3 1175 B6R0.6 C=COCCOC MCULE-6845218696 [0,1,0,0,0,0|0,0,2]=3 1176 B6R0.6 C=COCCON MCULE-8247202981 [0,1,0,0,0,0|0,0,2]=3 1177 B6R0.6 CC#CCCCBr MCULE-8545908172 [0,1,0,0,0,0|2,0,1]=4 1178 B6R0.6 CC#CCCCC MCULE-1899332515 [0,1,0,0,0,0|2,0,1]=4 1179 B6R0.6 CC#CCCCO MCULE-6502564684 [0,1,0,0,0,0|1,0,1]=3 1180 B6R0.6 CC/C=C/CCC MCULE-5222700461 [0,1,0,0,0,0|2,0,0]=3 1181 B6R0.6 CC/C=C/CCO MCULE-9853729917 [0,1,0,0,0,0|1,0,0]=2 1182 B6R0.6 CC/C=C\CC=O MCULE-1715953159 [0,1,0,0,0,0|1,0,2]=4 1183 B6R0.6 CC/C=C\CCO MCULE-9206958060 [0,1,0,0,0,0|1,0,0]=2 1184 B6R0.6 CC=CC=CCO MCULE-1802738822 [0,1,0,0,0,0|1,0,2]=4 1185 B6R0.6 CC=CCCCBr MCULE-1109208969 [0,1,0,0,0,0|2,0,1]=4 1186 B6R0.6 CC=CCCCC MCULE-7277981733 [0,1,0,0,0,0|2,0,1]=4 1187 B6R0.6 CC=CCCCCl MCULE-7487798637 [0,1,0,0,0,0|2,0,1]=4 1188 B6R0.6 CC=CCCCO MCULE-1401303632 [0,1,0,0,0,0|1,0,1]=3 1189 B6R0.6 CC=CSCCC MCULE-3534082442 [0,1,0,0,0,0|1,1,1]=4 1190 B6R0.6 CCC#CCC=O MCULE-4049790039 [0,1,0,0,0,0|1,0,2]=4 1191 B6R0.6 CCC#CCCBr MCULE-2188447221 [0,1,0,0,0,0|2,0,0]=3 1192 B6R0.6 CCC#CCCC MCULE-9615607532 [0,1,0,0,0,0|2,0,0]=3 1193 B6R0.6 CCC#CCCO MCULE-1699744538 [0,1,0,0,0,0|1,0,0]=2 1194 B6R0.6 CCC=CCC=O MCULE-5764198290 [0,1,0,0,0,0|1,0,2]=4 1195 B6R0.6 CCC=CCCBr MCULE-7873583643 [0,1,0,0,0,0|2,0,0]=3 1196 B6R0.6 CCC=CCCC MCULE-3739501724 [0,1,0,0,0,0|2,0,0]=3 1197 B6R0.6 CCC=CCCI MCULE-9416216252 [0,1,0,0,0,0|2,0,0]=3 1198 B6R0.6 CCC=CCCO MCULE-1781375433 [0,1,0,0,0,0|1,0,0]=2 1199 B6R0.6 CCC=COCC MCULE-1991976030 [0,1,0,0,0,0|1,0,1]=3 1200 B6R0.6 CCCC#CCO MCULE-8352024607 [0,1,0,0,0,0|1,0,1]=3 1201 B6R0.6 CCCC=CCBr MCULE-2474104566 [0,1,0,0,0,0|2,0,1]=4 1202 B6R0.6 CCCC=CCO MCULE-3204738641 [0,1,0,0,0,0|1,0,1]=3 1203 B6R0.6 CCCCCC#N MCULE-7596791521 [0,1,0,0,0,0|2,0,0]=3 1204 B6R0.6 CCCCCC=O MCULE-6770578514 [0,1,0,0,0,0|1,0,1]=3 1205 B6R0.6 CCCCCCBr MCULE-6022503394 [0,1,0,0,0,0|2,0,0]=3 1206 B6R0.6 CCCCCCC MCULE-5817084747 [0,1,0,0,0,0|2,0,0]=3 1207 B6R0.6 CCCCCCCl MCULE-3706149525 [0,1,0,0,0,0|2,0,0]=3 1208 B6R0.6 CCCCCCF MCULE-4320903575 [0,1,0,0,0,0|2,0,0]=3 1209 B6R0.6 CCCCCCI MCULE-1021236615 [0,1,0,0,0,0|2,0,0]=3 1210 B6R0.6 CCCCCCN MCULE-2944455155 [0,1,0,0,0,0|2,0,0]=3 1211 B6R0.6 CCCCCCN MCULE-6014217174 [0,1,0,0,0,0|2,0,0]=3 1212 B6R0.6 CCCCCCN MCULE-6021451227 [0,1,0,0,0,0|2,0,0]=3 1213 B6R0.6 CCCCCCO MCULE-4299150163 [0,1,0,0,0,0|1,0,0]=2 1214 B6R0.6 CCCCCCS MCULE-5962964855 [0,1,0,0,0,0|1,1,0]=3 1215 B6R0.6 CCCCCNC MCULE-8082703734 [0,1,0,0,0,0|2,0,0]=3 1216 B6R0.6 CCCCCNN MCULE-5089668540 [0,1,0,0,0,0|2,0,0]=3 1217 B6R0.6 CCCCCNN MCULE-7265120524 [0,1,0,0,0,0|2,0,0]=3 1218 B6R0.6 CCCCCOC MCULE-3370181741 [0,1,0,0,0,0|1,0,0]=2 1219 B6R0.6 CCCCCON MCULE-5372426564 [0,1,0,0,0,0|1,0,0]=2 1220 B6R0.6 CCCCCON MCULE-8557641459 [0,1,0,0,0,0|1,0,0]=2 1221 B6R0.6 CCCCCSC MCULE-6566108868 [0,1,0,0,0,0|1,1,0]=3 1222 B6R0.6 CCCCN=C=O MCULE-3381327717 [0,1,0,0,0,0|1,0,2]=4 1223 B6R0.6 CCCCN=C=S MCULE-3952129182 [0,1,0,0,0,0|1,1,1]=4 1224 B6R0.6 CCCCN=N#N MCULE-4207638779 [0,1,0,0,0,0|3,0,0]=4 1225 B6R0.6 CCCCNC=O MCULE-8821792924 [0,1,0,0,0,0|1,0,2]=4 1226 B6R0.6 CCCCNCC MCULE-8816750429 [0,1,0,0,0,0|2,0,0]=3 1227 B6R0.6 CCCCNOC MCULE-4265481432 [0,1,0,0,0,0|2,0,0]=3 1228 B6R0.6 CCCCOC=O MCULE-4633421026 [0,1,0,0,0,0|1,0,2]=4 1229 B6R0.6 CCCCOCC MCULE-5662731951 [0,1,0,0,0,0|1,0,0]=2 1230 B6R0.6 CCCCOCCl MCULE-5282964693 [0,1,0,0,0,0|2,0,0]=3 1231 B6R0.6 CCCCON=O MCULE-9992790020 [0,1,0,0,0,0|2,0,1]=4 1232 B6R0.6 CCCCSC#N MCULE-4585387956 [0,1,0,0,0,0|2,0,1]=4 1233 B6R0.6 CCCCSCC MCULE-4832924468 [0,1,0,0,0,0|1,1,0]=3 1234 B6R0.6 CCCCSCCl MCULE-4907770015 [0,1,0,0,0,0|2,0,0]=3 1235 B6R0.6 CCCNCC#N MCULE-3452380054 [0,1,0,0,0,0|2,0,1]=4 1236 B6R0.6 CCCNCCC MCULE-1452672638 [0,1,0,0,0,0|2,0,0]=3 1237 B6R0.6 CCCNCCC MCULE-6223802621 [0,1,0,0,0,0|2,0,0]=3 1238 B6R0.6 CCCNCCC MCULE-6789654118 [0,1,0,0,0,0|2,0,0]=3 1239 B6R0.6 CCCNCCN MCULE-2288945868 [0,1,0,0,0,0|2,0,0]=3 1240 B6R0.6 CCCNCCO MCULE-4813687741 [0,1,0,0,0,0|1,0,0]=2 1241 B6R0.6 CCCNOCC MCULE-1349462426 [0,1,0,0,0,0|1,0,0]=2 1242 B6R0.6 CCCNOCC MCULE-7159087335 [0,1,0,0,0,0|1,0,0]=2 1243 B6R0.6 CCCOCC#N MCULE-7011471802 [0,1,0,0,0,0|1,0,1]=3 1244 B6R0.6 CCCOCCC MCULE-1390130917 [0,1,0,0,0,0|1,0,0]=2 1245 B6R0.6 CCCOCCCl MCULE-6561613708 [0,1,0,0,0,0|1,0,0]=2 1246 B6R0.6 CCCOCCI MCULE-5330098176 [0,1,0,0,0,0|1,0,0]=2 1247 B6R0.6 CCCOCCN MCULE-1987261931 [0,1,0,0,0,0|1,0,0]=2 1248 B6R0.6 CCCOCCN MCULE-9033871038 [0,1,0,0,0,0|1,0,0]=2 1249 B6R0.6 CCCOCCO MCULE-3263526264 [0,1,0,0,0,0|0,0,0]=1 1250 B6R0.6 CCCSCCC MCULE-5531652471 [0,1,0,0,0,0|1,1,0]=3 1251 B6R0.6 CCCSCCN MCULE-3934428121 [0,1,0,0,0,0|1,1,0]=3 1252 B6R0.6 CCCSCCN MCULE-5705755172 [0,1,0,0,0,0|1,1,0]=3 1253 B6R0.6 CCCSCCO MCULE-8371796663 [0,1,0,0,0,0|0,1,0]=2 1254 B6R0.6 CCCSSCC MCULE-7192921435 [0,1,0,0,0,0|1,1,0]=3 1255 B6R0.6 CCNCCC#N MCULE-8589229962 [0,1,0,0,0,0|2,0,0]=3 1256 B6R0.6 CCNCCCN MCULE-5811169148 [0,1,0,0,0,0|2,0,0]=3 1257 B6R0.6 CCNCCCO MCULE-3251610052 [0,1,0,0,0,0|1,0,0]=2 1258 B6R0.6 CCNCCNC MCULE-9372339393 [0,1,0,0,0,0|2,0,0]=3 1259 B6R0.6 CCNCCOC MCULE-1476772953 [0,1,0,0,0,0|1,0,0]=2 1260 B6R0.6 CCNCCOC MCULE-6652489795 [0,1,0,0,0,0|1,0,0]=2 1261 B6R0.6 CCNCCSC MCULE-1736157320 [0,1,0,0,0,0|1,1,0]=3 1262 B6R0.6 CCNCCSC MCULE-9369049891 [0,1,0,0,0,0|1,1,0]=3 1263 B6R0.6 CCO/C=C/C#N MCULE-4278586794 [0,1,0,0,0,0|1,0,2]=4 1264 B6R0.6 CCO/C=N\C#N MCULE-1650776311 [0,1,0,0,0,0|1,0,2]=4 1265 B6R0.6 CCOC=CC#N MCULE-5002780993 [0,1,0,0,0,0|1,0,2]=4 1266 B6R0.6 CCOC=NC#N MCULE-9724347917 [0,1,0,0,0,0|1,0,2]=4 1267 B6R0.6 CCOCCC#N MCULE-4907543374 [0,1,0,0,0,0|1,0,0]=2 1268 B6R0.6 CCOCCC=O MCULE-1664130148 [0,1,0,0,0,0|0,0,1]=2 1269 B6R0.6 CCOCCCBr MCULE-6544747281 [0,1,0,0,0,0|1,0,0]=2 1270 B6R0.6 CCOCCCCl MCULE-8523618681 [0,1,0,0,0,0|1,0,0]=2 1271 B6R0.6 CCOCCCI MCULE-6640732668 [0,1,0,0,0,0|1,0,0]=2 1272 B6R0.6 CCOCCCN MCULE-3491529722 [0,1,0,0,0,0|1,0,0]=2 1273 B6R0.6 CCOCCCO MCULE-3077567484 [0,1,0,0,0,0|0,0,0]=1 1274 B6R0.6 CCOCCNC MCULE-5244682559 [0,1,0,0,0,0|1,0,0]=2 1275 B6R0.6 CCOCCNC MCULE-9344296133 [0,1,0,0,0,0|1,0,0]=2 1276 B6R0.6 CCOCCNN MCULE-2995792378 [0,1,0,0,0,0|1,0,0]=2 1277 B6R0.6 CCOCCNN MCULE-7756116612 [0,1,0,0,0,0|1,0,0]=2 1278 B6R0.6 CCOCCOC MCULE-2753000412 [0,1,0,0,0,0|0,0,0]=1 1279 B6R0.6 CCOCCON MCULE-6072859154 [0,1,0,0,0,0|0,0,0]=1 1280 B6R0.6 CCOCCON MCULE-7716477934 [0,1,0,0,0,0|0,0,0]=1 1281 B6R0.6 CCOCOCC MCULE-3885854108 [0,1,0,0,0,0|1,0,0]=2 1282 B6R0.6 CCSCCC=O MCULE-2493452950 [0,1,0,0,0,0|0,1,1]=3 1283 B6R0.6 CCSCCCBr MCULE-5143634954 [0,1,0,0,0,0|1,1,0]=3 1284 B6R0.6 CCSCCCN MCULE-4566450606 [0,1,0,0,0,0|1,1,0]=3 1285 B6R0.6 CCSCCCO MCULE-6719011943 [0,1,0,0,0,0|0,1,0]=2 1286 B6R0.6 CCSCCNC MCULE-6159594076 [0,1,0,0,0,0|1,1,0]=3 1287 B6R0.6 CCSCCNC MCULE-6696154047 [0,1,0,0,0,0|1,1,0]=3 1288 B6R0.6 CCSCSCC MCULE-6005869091 [0,1,0,0,0,0|1,1,0]=3 1289 B6R0.6 CCSSSCC MCULE-7754450209 [0,1,0,0,0,0|2,1,0]=4 1290 B6R0.6 CNCC#CCO MCULE-4900527922 [0,1,0,0,0,0|1,0,1]=3 1291 B6R0.6 CNCCCC#N MCULE-2995077554 [0,1,0,0,0,0|2,0,1]=4 1292 B6R0.6 CNCCCC#N MCULE-4831210709 [0,1,0,0,0,0|2,0,1]=4 1293 B6R0.6 CNCCCCBr MCULE-4148452640 [0,1,0,0,0,0|2,0,0]=3 1294 B6R0.6 CNCCCCBr MCULE-8686440557 [0,1,0,0,0,0|2,0,0]=3 1295 B6R0.6 CNCCCCCl MCULE-1170786568 [0,1,0,0,0,0|2,0,0]=3 1296 B6R0.6 CNCCCCCl MCULE-1726466829 [0,1,0,0,0,0|2,0,0]=3 1297 B6R0.6 CNCCCCN MCULE-2542685963 [0,1,0,0,0,0|2,0,0]=3 1298 B6R0.6 CNCCCCN MCULE-7925344560 [0,1,0,0,0,0|2,0,0]=3 1299 B6R0.6 CNCCCCO MCULE-9264393637 [0,1,0,0,0,0|1,0,0]=2 1300 B6R0.6 CNCCCNC MCULE-3840224541 [0,1,0,0,0,0|3,0,0]=4 1301 B6R0.6 CNCCCOC MCULE-4057126907 [0,1,0,0,0,0|2,0,0]=3 1302 B6R0.6 CNCCCOC MCULE-8552551858 [0,1,0,0,0,0|2,0,0]=3 1303 B6R0.6 CNCCCSC MCULE-6553998750 [0,1,0,0,0,0|2,1,0]=4 1304 B6R0.6 CNOCCOC MCULE-2652662364 [0,1,0,0,0,0|1,0,0]=2 1305 B6R0.6 CNOCCOC MCULE-3394597000 [0,1,0,0,0,0|1,0,0]=2 1306 B6R0.6 COCC#CCCl MCULE-2143739767 [0,1,0,0,0,0|2,0,1]=4 1307 B6R0.6 COCCCC#N MCULE-8739581354 [0,1,0,0,0,0|2,0,1]=4 1308 B6R0.6 COCCCC=O MCULE-2055914202 [0,1,0,0,0,0|1,0,2]=4 1309 B6R0.6 COCCCCBr MCULE-7500019583 [0,1,0,0,0,0|2,0,0]=3 1310 B6R0.6 COCCCCCl MCULE-3863170338 [0,1,0,0,0,0|2,0,0]=3 1311 B6R0.6 COCCCCN MCULE-9584631056 [0,1,0,0,0,0|2,0,0]=3 1312 B6R0.6 COCCCCO MCULE-2543196930 [0,1,0,0,0,0|1,0,0]=2 1313 B6R0.6 COCCCCO MCULE-8659106280 [0,1,0,0,0,0|1,0,0]=2 1314 B6R0.6 COCCCNN MCULE-5097653856 [0,1,0,0,0,0|3,0,0]=4 1315 B6R0.6 COCCCNN MCULE-7758841774 [0,1,0,0,0,0|3,0,0]=4 1316 B6R0.6 COCCCOC MCULE-5003816236 [0,1,0,0,0,0|2,0,0]=3 1317 B6R0.6 COCCCON MCULE-3859091617 [0,1,0,0,0,0|2,0,0]=3 1318 B6R0.6 COCCCON MCULE-4419390097 [0,1,0,0,0,0|2,0,0]=3 1319 B6R0.6 COCCN=C=O MCULE-7139432642 [0,1,0,0,0,0|2,0,1]=4 1320 B6R0.6 COCCN=C=S MCULE-4661994491 [0,1,0,0,0,0|2,0,1]=4 1321 B6R0.6 COCCN=N#N MCULE-2613703286 [0,1,0,0,0,0|3,0,0]=4 1322 B6R0.6 COCCNC=O MCULE-9003279073 [0,1,0,0,0,0|2,0,1]=4 1323 B6R0.6 COCCOCCl MCULE-6701095927 [0,1,0,0,0,0|1,0,0]=2 1324 B6R0.6 COCOCCBr MCULE-8856323357 [0,1,0,0,0,0|1,0,0]=2 1325 B6R0.6 COCOCCI MCULE-4444019738 [0,1,0,0,0,0|1,0,0]=2 1326 B6R0.6 COCOCCN MCULE-7974740048 [0,1,0,0,0,0|1,0,0]=2 1327 B6R0.6 COCOCCO MCULE-8093241209 [0,1,0,0,0,0|0,0,0]=1 1328 B6R0.6 COCOCOC MCULE-9183615159 [0,1,0,0,0,0|2,0,0]=3 1329 B6R0.6 CONCCCN MCULE-4780444103 [0,1,0,0,0,0|3,0,0]=4 1330 B6R0.6 CONCCCN MCULE-6095720673 [0,1,0,0,0,0|3,0,0]=4 1331 B6R0.6 CONCCCN MCULE-9121351484 [0,1,0,0,0,0|3,0,0]=4 1332 B6R0.6 CSCCCC=O MCULE-6353729217 [0,1,0,0,0,0|1,0,2]=4 1333 B6R0.6 CSCCCCN MCULE-2391033479 [0,1,0,0,0,0|2,0,0]=3 1334 B6R0.6 CSCCCCO MCULE-1045422424 [0,1,0,0,0,0|1,0,0]=2 1335 B6R0.6 CSCCCON MCULE-2543326517 [0,1,0,0,0,0|2,0,0]=3 1336 B6R0.6 CSCCCSC MCULE-6993538101 [0,1,0,0,0,0|2,1,0]=4 1337 B6R0.6 ClCCCCCBr MCULE-6767883252 [0,1,0,0,0,0|2,0,0]=3 1338 B6R0.6 ClCCCCCCl MCULE-9302388009 [0,1,0,0,0,0|2,0,0]=3 1339 B6R0.6 ClCCCCCI MCULE-2173931817 [0,1,0,0,0,0|2,0,0]=3 1340 B6R0.6 ClCCNCCCl MCULE-2453447059 [0,1,0,0,0,0|2,0,0]=3 1341 B6R0.6 ClCCOCCCl MCULE-2189904184 [0,1,0,0,0,0|1,0,0]=2 1342 B6R0.6 ClCCOCCI MCULE-8666203040 [0,1,0,0,0,0|1,0,0]=2 1343 B6R0.6 FCCCCCBr MCULE-1314383985 [0,1,0,0,0,0|2,0,0]=3 1344 B6R0.6 ICCCCCI MCULE-2889089700 [0,1,0,0,0,0|2,0,0]=3 1345 B6R0.6 ICCOCCI MCULE-8427607007 [0,1,0,0,0,0|1,0,0]=2 1346 B6R0.6 N#CCC=CCO MCULE-6995751332 [0,1,0,0,0,0|1,0,2]=4 1347 B6R0.6 N#CCCCCBr MCULE-7152608116 [0,1,0,0,0,0|2,0,1]=4 1348 B6R0.6 N#CCCCCCl MCULE-9317036806 [0,1,0,0,0,0|2,0,1]=4 1349 B6R0.6 N#CCCCCF MCULE-1200512715 [0,1,0,0,0,0|2,0,1]=4 1350 B6R0.6 N#CCCCCI MCULE-8000340428 [0,1,0,0,0,0|2,0,1]=4 1351 B6R0.6 N#CCCCCN MCULE-4183048720 [0,1,0,0,0,0|2,0,1]=4 1352 B6R0.6 N#CCCCCN MCULE-4775375165 [0,1,0,0,0,0|2,0,1]=4 1353 B6R0.6 N#CCCCCO MCULE-4289736283 [0,1,0,0,0,0|1,0,1]=3 1354 B6R0.6 N#CCCCCS MCULE-6284171080 [0,1,0,0,0,0|1,1,1]=4 1355 B6R0.6 N#CCOCCCl MCULE-7348074062 [0,1,0,0,0,0|1,0,1]=3 1356 B6R0.6 N#N=NCCCO MCULE-3148876760 [0,1,0,0,0,0|3,0,0]=4 1357 B6R0.6 NCC=CCCN MCULE-5058870063 [0,1,0,0,0,0|2,0,1]=4 1358 B6R0.6 NCC=CCCN MCULE-6332692206 [0,1,0,0,0,0|2,0,1]=4 1359 B6R0.6 NCCCCCBr MCULE-3577483607 [0,1,0,0,0,0|2,0,0]=3 1360 B6R0.6 NCCCCCBr MCULE-7572691537 [0,1,0,0,0,0|2,0,0]=3 1361 B6R0.6 NCCCCCF MCULE-1057270243 [0,1,0,0,0,0|2,0,0]=3 1362 B6R0.6 NCCCCCN MCULE-3785554987 [0,1,0,0,0,0|2,0,0]=3 1363 B6R0.6 NCCCCCN MCULE-5173983982 [0,1,0,0,0,0|2,0,0]=3 1364 B6R0.6 NCCCCCO MCULE-8877250712 [0,1,0,0,0,0|1,0,0]=2 1365 B6R0.6 NCCCCCS MCULE-1813104379 [0,1,0,0,0,0|1,1,0]=3 1366 B6R0.6 NCCCCCS MCULE-6081835870 [0,1,0,0,0,0|1,1,0]=3 1367 B6R0.6 NCCCCNO MCULE-6478748569 [0,1,0,0,0,0|2,0,0]=3 1368 B6R0.6 NCCNCCCl MCULE-8909584172 [0,1,0,0,0,0|2,0,0]=3 1369 B6R0.6 NCCNCCCl MCULE-9412103836 [0,1,0,0,0,0|2,0,0]=3 1370 B6R0.6 NCCNCCN MCULE-4710767146 [0,1,0,0,0,0|2,0,0]=3 1371 B6R0.6 NCCNCCN MCULE-4803305991 [0,1,0,0,0,0|2,0,0]=3 1372 B6R0.6 NCCNCCO MCULE-2112359407 [0,1,0,0,0,0|1,0,0]=2 1373 B6R0.6 NCCOCCBr MCULE-6520580224 [0,1,0,0,0,0|1,0,0]=2 1374 B6R0.6 NCCOCCCl MCULE-1975521529 [0,1,0,0,0,0|1,0,0]=2 1375 B6R0.6 NCCOCCCl MCULE-9715175348 [0,1,0,0,0,0|1,0,0]=2 1376 B6R0.6 NCCOCCF MCULE-4126568309 [0,1,0,0,0,0|1,0,0]=2 1377 B6R0.6 NCCOCCF MCULE-4641621710 [0,1,0,0,0,0|1,0,0]=2 1378 B6R0.6 NCCOCCN MCULE-1630934305 [0,1,0,0,0,0|1,0,0]=2 1379 B6R0.6 NCCOCCN MCULE-3282393357 [0,1,0,0,0,0|1,0,0]=2 1380 B6R0.6 NCCOCCN MCULE-3788231540 [0,1,0,0,0,0|1,0,0]=2 1381 B6R0.6 NCCOCCO MCULE-1073574088 [0,1,0,0,0,0|0,0,0]=1 1382 B6R0.6 NCCSCCN MCULE-4317147284 [0,1,0,0,0,0|1,1,0]=3 1383 B6R0.6 NCCSCCN MCULE-5449033874 [0,1,0,0,0,0|1,1,0]=3 1384 B6R0.6 NCCSCCO MCULE-1475378446 [0,1,0,0,0,0|0,1,0]=2 1385 B6R0.6 NNCCCCO MCULE-3928748589 [0,1,0,0,0,0|2,0,0]=3 1386 B6R0.6 NOCCCON MCULE-1133530094 [0,1,0,0,0,0|3,0,0]=4 1387 B6R0.6 NOCCCON MCULE-5394799847 [0,1,0,0,0,0|3,0,0]=4 1388 B6R0.6 O=CCCCCCl MCULE-1257670284 [0,1,0,0,0,0|1,0,2]=4 1389 B6R0.6 O=CCCCCO MCULE-7959082228 [0,1,0,0,0,0|1,0,1]=3 1390 B6R0.6 O=CNCCCO MCULE-7926485528 [0,1,0,0,0,0|2,0,1]=4 1391 B6R0.6 O=NCNCCO MCULE-4478167391 [0,1,0,0,0,0|2,0,0]=3 1392 B6R0.6 OCCCCCBr MCULE-1444733196 [0,1,0,0,0,0|1,0,0]=2 1393 B6R0.6 OCCCCCCl MCULE-5666058059 [0,1,0,0,0,0|1,0,0]=2 1394 B6R0.6 OCCCCCF MCULE-9253204275 [0,1,0,0,0,0|1,0,0]=2 1395 B6R0.6 OCCCCCI MCULE-8707758496 [0,1,0,0,0,0|1,0,0]=2 1396 B6R0.6 OCCCCCO MCULE-1044076048 [0,1,0,0,0,0|1,0,0]=2 1397 B6R0.6 OCCNCCCl MCULE-7809492267 [0,1,0,0,0,0|1,0,0]=2 1398 B6R0.6 OCCNCCCl MCULE-9007709158 [0,1,0,0,0,0|1,0,0]=2 1399 B6R0.6 OCCNCCO MCULE-9183096746 [0,1,0,0,0,0|1,0,0]=2 1400 B6R0.6 OCCNCCO MCULE-9803420258 [0,1,0,0,0,0|1,0,0]=2 1401 B6R0.6 OCCOCCBr MCULE-2641000270 [0,1,0,0,0,0|0,0,0]=1 1402 B6R0.6 OCCOCCCl MCULE-7320539957 [0,1,0,0,0,0|0,0,0]=1 1403 B6R0.6 OCCOCCF MCULE-1780385479 [0,1,0,0,0,0|0,0,0]=1 1404 B6R0.6 OCCOCCI MCULE-1083607130 [0,1,0,0,0,0|0,0,0]=1 1405 B6R0.6 OCCOCCO MCULE-1531783732 [0,1,0,0,0,0|0,0,0]=1 1406 B6R0.6 OCCSCCO MCULE-5502656030 [0,1,0,0,0,0|0,1,0]=2 1407 B6R0.6 OCCSCCS MCULE-4418561990 [0,1,0,0,0,0|0,1,0]=2 1408 B6R0.6 SCCCCCS MCULE-4899719552 [0,1,0,0,0,0|1,1,0]=3 1409 B6R0.6 SCCOCCS MCULE-6659110232 [0,1,0,0,0,0|0,1,0]=2 1410 B6R0.6 SCCSCCS MCULE-1219600644 [0,1,0,0,0,0|0,2,0]=3 1411 B6R0.6 [NH2+](CCCl)CCCl MCULE-9020671822 [0,1,0,0,0,0|2,0,0]=3 1412 B6R1.1 C1=CCCCC1 MCULE-3564016252 [0,0,0,1,0,0|2,0,1]=4 1413 B6R1.1 C1=CCNCC1 MCULE-4850984502 [0,0,0,1,0,0|2,0,1]=4 1414 B6R1.1 C1=CCNCC1 MCULE-9744767398 [0,0,0,1,0,0|2,0,1]=4 1415 B6R1.1 C1=CCOCC1 MCULE-7723901693 [0,0,0,1,0,0|1,0,1]=3 1416 B6R1.1 C1=CCONC1 MCULE-7264346127 [0,0,0,1,0,0|2,0,1]=4 1417 B6R1.1 C1=CCONC1 MCULE-7621269131 [0,0,0,1,0,0|2,0,1]=4 1418 B6R1.1 C1=COCCC1 MCULE-1260841717 [0,0,0,1,0,0|1,0,2]=4 1419 B6R1.1 C1=COCCO1 MCULE-2562788031 [0,0,0,1,0,0|0,0,2]=3 1420 B6R1.1 C1=COCOC1 MCULE-9916358884 [0,0,0,1,0,0|2,0,1]=4 1421 B6R1.1 C1=NCCCC1 MCULE-7101012273 [0,0,0,1,0,0|2,0,1]=4 1422 B6R1.1 C1CCCCC1 MCULE-3136361765 [0,0,0,1,0,0|2,0,0]=3 1423 B6R1.1 C1CCNCC1 MCULE-4094049864 [0,0,0,1,0,0|2,0,0]=3 1424 B6R1.1 C1CCNNC1 MCULE-6440414301 [0,0,0,1,0,0|3,0,0]=4 1425 B6R1.1 C1CCNNC1 MCULE-6764314654 [0,0,0,1,0,0|3,0,0]=4 1426 B6R1.1 C1CCOCC1 MCULE-6904583049 [0,0,0,1,0,0|1,0,0]=2 1427 B6R1.1 C1CCONC1 MCULE-4106728300 [0,0,0,1,0,0|2,0,0]=3 1428 B6R1.1 C1CCONC1 MCULE-7653057344 [0,0,0,1,0,0|2,0,0]=3 1429 B6R1.1 C1CCSCC1 MCULE-5775966946 [0,0,0,1,0,0|1,1,0]=3 1430 B6R1.1 C1CNCCN1 MCULE-1581360805 [0,0,0,1,0,0|2,0,0]=3 1431 B6R1.1 C1CNCCN1 MCULE-3262369531 [0,0,0,1,0,0|2,0,0]=3 1432 B6R1.1 C1CNCCN1 MCULE-4322783360 [0,0,0,1,0,0|2,0,0]=3 1433 B6R1.1 C1CNCCN1 MCULE-5522245554 [0,0,0,1,0,0|2,0,0]=3 1434 B6R1.1 C1CNCCN1 MCULE-6779430492 [0,0,0,1,0,0|2,0,0]=3 1435 B6R1.1 C1CNCCN1 MCULE-9358926351 [0,0,0,1,0,0|2,0,0]=3 1436 B6R1.1 C1CNCCN1 MCULE-9768146432 [0,0,0,1,0,0|2,0,0]=3 1437 B6R1.1 C1CNCOC1 MCULE-7862832103 [0,0,0,1,0,0|2,0,0]=3 1438 B6R1.1 C1CNCSC1 MCULE-2728084068 [0,0,0,1,0,0|2,1,0]=4 1439 B6R1.1 C1CNCSC1 MCULE-3301332730 [0,0,0,1,0,0|2,1,0]=4 1440 B6R1.1 C1COCCN1 MCULE-2533030492 [0,0,0,1,0,0|1,0,0]=2 1441 B6R1.1 C1COCCN1 MCULE-4684386765 [0,0,0,1,0,0|1,0,0]=2 1442 B6R1.1 C1COCCN1 MCULE-8040983584 [0,0,0,1,0,0|1,0,0]=2 1443 B6R1.1 C1COCCO1 MCULE-5088019198 [0,0,0,1,0,0|0,0,0]=1 1444 B6R1.1 C1COCC[NH2+]1 MCULE-5238323153 [0,0,0,1,0,0|1,0,0]=2 1445 B6R1.1 C1COCOC1 MCULE-3698539550 [0,0,0,1,0,0|2,0,0]=3 1446 B6R1.1 C1CSCCN1 MCULE-6420970424 [0,0,0,1,0,0|1,1,0]=3 1447 B6R1.1 C1CSCCN1 MCULE-8670233998 [0,0,0,1,0,0|1,1,0]=3 1448 B6R1.1 C1CSCCO1 MCULE-5803800470 [0,0,0,1,0,0|0,1,0]=2 1449 B6R1.1 C1CSCCS1 MCULE-6198913745 [0,0,0,1,0,0|0,2,0]=3 1450 B6R1.1 C1CSCSC1 MCULE-5626011651 [0,0,0,1,0,0|2,1,0]=4 1451 B6R1.1 C1C[Se]CCN1 MCULE-6480197745 [0,0,0,1,0,0|1,1,0]=3 1452 B6R1.1 C1OCOCO1 MCULE-9548551067 [0,0,0,1,0,0|3,0,0]=4 1453 B6R1.2 BrC1=COCC1 MCULE-8057569313 [0,0,0,1,0,0|1,0,2]=4 1454 B6R1.2 BrC1CC=CC1 MCULE-8834603275 [0,0,0,1,0,0|2,0,1]=4 1455 B6R1.2 BrC1CCCC1 MCULE-9383923023 [0,0,0,1,0,0|2,0,0]=3 1456 B6R1.2 BrC1CCNC1 MCULE-4841543716 [0,0,0,1,0,0|2,0,0]=3 1457 B6R1.2 BrC1CCNC1 MCULE-4954951045 [0,0,0,1,0,0|2,0,0]=3 1458 B6R1.2 BrC1CCNC1 MCULE-7176123276 [0,0,0,1,0,0|2,0,0]=3 1459 B6R1.2 BrC1CCOC1 MCULE-7037144528 [0,0,0,1,0,0|1,0,0]=2 1460 B6R1.2 BrC1CCSC1 MCULE-6663716947 [0,0,0,1,0,0|1,1,0]=3 1461 B6R1.2 Br[C@@H]1CCNC1 MCULE-1681494552 [0,0,0,1,0,0|2,0,0]=3 1462 B6R1.2 Br[C@@H]1CCNC1 MCULE-1764777534 [0,0,0,1,0,0|2,0,0]=3 1463 B6R1.2 Br[C@@H]1CCNC1 MCULE-2455801012 [0,0,0,1,0,0|2,0,0]=3 1464 B6R1.2 Br[C@@H]1CCNC1 MCULE-8945784733 [0,0,0,1,0,0|2,0,0]=3 1465 B6R1.2 Br[C@H]1CCNC1 MCULE-5014033994 [0,0,0,1,0,0|2,0,0]=3 1466 B6R1.2 Br[C@H]1CCNC1 MCULE-5217617272 [0,0,0,1,0,0|2,0,0]=3 1467 B6R1.2 Br[C@H]1CCNC1 MCULE-8899453530 [0,0,0,1,0,0|2,0,0]=3 1468 B6R1.2 Br[C@H]1CCNC1 MCULE-9461718131 [0,0,0,1,0,0|2,0,0]=3 1469 B6R1.2 Br[C@H]1CCOC1 MCULE-7554969036 [0,0,0,1,0,0|1,0,0]=2 1470 B6R1.2 C1(CCNC1)C MCULE-2542646403 [0,0,0,1,0,0|2,0,0]=3 1471 B6R1.2 C1(CCNC1)C MCULE-4538835016 [0,0,0,1,0,0|2,0,0]=3 1472 B6R1.2 C1(CCNC1)F MCULE-2259566125 [0,0,0,1,0,0|2,0,0]=3 1473 B6R1.2 C1(CCNC1)F MCULE-3325393466 [0,0,0,1,0,0|2,0,0]=3 1474 B6R1.2 C1(CCNC1)O MCULE-2676539647 [0,0,0,1,0,0|1,0,0]=2 1475 B6R1.2 C1(CCNC1)O MCULE-4228466615 [0,0,0,1,0,0|1,0,0]=2 1476 B6R1.2 C1(CCOC1)I MCULE-4877322062 [0,0,0,1,0,0|1,0,0]=2 1477 B6R1.2 C1(CCOC1)N MCULE-2221007915 [0,0,0,1,0,0|1,0,0]=2 1478 B6R1.2 C1(CCOC1)N MCULE-3972931474 [0,0,0,1,0,0|1,0,0]=2 1479 B6R1.2 C1(CCOC1)O MCULE-3631749536 [0,0,0,1,0,0|0,0,0]=1 1480 B6R1.2 C=C1CCCC1 MCULE-4115373196 [0,0,0,1,0,0|2,0,1]=4 1481 B6R1.2 C=C1CCNC1 MCULE-7982953073 [0,0,0,1,0,0|2,0,1]=4 1482 B6R1.2 C=C1CCNC1 MCULE-8428731599 [0,0,0,1,0,0|2,0,1]=4 1483 B6R1.2 C=C1CCSC1 MCULE-7042571473 [0,0,0,1,0,0|1,1,1]=4 1484 B6R1.2 CC1=CCCC1 MCULE-8508688474 [0,0,0,1,0,0|2,0,1]=4 1485 B6R1.2 CC1=CCCO1 MCULE-7276659214 [0,0,0,1,0,0|1,0,1]=3 1486 B6R1.2 CC1=NCCC1 MCULE-5009170423 [0,0,0,1,0,0|2,0,1]=4 1487 B6R1.2 CC1=NCCN1 MCULE-4787238872 [0,0,0,1,0,0|2,0,1]=4 1488 B6R1.2 CC1=NCCO1 MCULE-8564633040 [0,0,0,1,0,0|1,0,1]=3 1489 B6R1.2 CC1=NCCS1 MCULE-1701303405 [0,0,0,1,0,0|1,1,1]=4 1490 B6R1.2 CC1C=CCC1 MCULE-1638534048 [0,0,0,1,0,0|2,0,1]=4 1491 B6R1.2 CC1CCCC1 MCULE-4702116068 [0,0,0,1,0,0|2,0,0]=3 1492 B6R1.2 CC1CCCN1 MCULE-4853624560 [0,0,0,1,0,0|2,0,0]=3 1493 B6R1.2 CC1CCCN1 MCULE-5939948024 [0,0,0,1,0,0|2,0,0]=3 1494 B6R1.2 CC1CCCN1 MCULE-6020011445 [0,0,0,1,0,0|2,0,0]=3 1495 B6R1.2 CC1CCCN1 MCULE-7855346849 [0,0,0,1,0,0|2,0,0]=3 1496 B6R1.2 CC1CCCO1 MCULE-2526138687 [0,0,0,1,0,0|1,0,0]=2 1497 B6R1.2 CC1CCCS1 MCULE-8372499972 [0,0,0,1,0,0|1,1,0]=3 1498 B6R1.2 CC1CCNC1 MCULE-6494098173 [0,0,0,1,0,0|2,0,0]=3 1499 B6R1.2 CC1CCNC1 MCULE-8260364514 [0,0,0,1,0,0|2,0,0]=3 1500 B6R1.2 CC1CCOC1 MCULE-6424683416 [0,0,0,1,0,0|1,0,0]=2 1501 B6R1.2 CC1CCSC1 MCULE-7445511318 [0,0,0,1,0,0|1,1,0]=3 1502 B6R1.2 CC1CNOC1 MCULE-1071803164 [0,0,0,1,0,0|2,0,0]=3 1503 B6R1.2 CC1CNOC1 MCULE-9455391174 [0,0,0,1,0,0|2,0,0]=3 1504 B6R1.2 CC1COCO1 MCULE-9332316279 [0,0,0,1,0,0|2,0,0]=3 1505 B6R1.2 CC1NCCS1 MCULE-8457840375 [0,0,0,1,0,0|1,1,0]=3 1506 B6R1.2 CC1OCCO1 MCULE-2943809591 [0,0,0,1,0,0|0,0,0]=1 1507 B6R1.2 CC1SCCS1 MCULE-5011453273 [0,0,0,1,0,0|0,2,0]=3 1508 B6R1.2 CN1CCCC1 MCULE-5387702231 [0,0,0,1,0,0|3,0,0]=4 1509 B6R1.2 CN1CCNC1 MCULE-8059197564 [0,0,0,1,0,0|3,0,0]=4 1510 B6R1.2 CN1CCNC1 MCULE-9818601515 [0,0,0,1,0,0|3,0,0]=4 1511 B6R1.2 CN1CCOC1 MCULE-5504672404 [0,0,0,1,0,0|2,0,0]=3 1512 B6R1.2 C[C@@H]1CCCN1 MCULE-1038329474 [0,0,0,1,0,0|2,0,0]=3 1513 B6R1.2 C[C@@H]1CCCN1 MCULE-1829999308 [0,0,0,1,0,0|2,0,0]=3 1514 B6R1.2 C[C@@H]1CCCN1 MCULE-8644278041 [0,0,0,1,0,0|2,0,0]=3 1515 B6R1.2 C[C@@H]1CCCN1 MCULE-9243990647 [0,0,0,1,0,0|2,0,0]=3 1516 B6R1.2 C[C@@H]1CCNC1 MCULE-5345577321 [0,0,0,1,0,0|2,0,0]=3 1517 B6R1.2 C[C@@H]1CCNC1 MCULE-5749945455 [0,0,0,1,0,0|2,0,0]=3 1518 B6R1.2 C[C@@H]1CCNC1 MCULE-8967606188 [0,0,0,1,0,0|2,0,0]=3 1519 B6R1.2 C[C@@H]1CCNC1 MCULE-8996756392 [0,0,0,1,0,0|2,0,0]=3 1520 B6R1.2 C[C@H]1CCCN1 MCULE-2078024663 [0,0,0,1,0,0|2,0,0]=3 1521 B6R1.2 C[C@H]1CCCN1 MCULE-3113877345 [0,0,0,1,0,0|2,0,0]=3 1522 B6R1.2 C[C@H]1CCCN1 MCULE-3426869473 [0,0,0,1,0,0|2,0,0]=3 1523 B6R1.2 C[C@H]1CCCN1 MCULE-5093266679 [0,0,0,1,0,0|2,0,0]=3 1524 B6R1.2 C[C@H]1CCNC1 MCULE-1866792897 [0,0,0,1,0,0|2,0,0]=3 1525 B6R1.2 C[C@H]1CCNC1 MCULE-3817248567 [0,0,0,1,0,0|2,0,0]=3 1526 B6R1.2 C[C@H]1CCNC1 MCULE-7938243226 [0,0,0,1,0,0|2,0,0]=3 1527 B6R1.2 C[C@H]1CCNC1 MCULE-8895875203 [0,0,0,1,0,0|2,0,0]=3 1528 B6R1.2 C[S+]1CCCC1 MCULE-6294888335 [0,0,0,1,0,0|3,0,0]=4 1529 B6R1.2 C[S+]1CCCC1 MCULE-8432227262 [0,0,0,1,0,0|3,0,0]=4 1530 B6R1.2 ClC1CCCC1 MCULE-3285928655 [0,0,0,1,0,0|2,0,0]=3 1531 B6R1.2 ClC1CCNC1 MCULE-5659561118 [0,0,0,1,0,0|2,0,0]=3 1532 B6R1.2 ClC1CCNC1 MCULE-6180477494 [0,0,0,1,0,0|2,0,0]=3 1533 B6R1.2 ClC1CCNC1 MCULE-6964859207 [0,0,0,1,0,0|2,0,0]=3 1534 B6R1.2 ClC1CCNC1 MCULE-8389509440 [0,0,0,1,0,0|2,0,0]=3 1535 B6R1.2 ClC1CCOC1 MCULE-6903762147 [0,0,0,1,0,0|1,0,0]=2 1536 B6R1.2 ClP1OCCO1 MCULE-2550894251 [0,0,0,1,0,0|2,0,0]=3 1537 B6R1.2 Cl[C@@H]1CCNC1 MCULE-3218152098 [0,0,0,1,0,0|2,0,0]=3 1538 B6R1.2 Cl[C@@H]1CCNC1 MCULE-6728755007 [0,0,0,1,0,0|2,0,0]=3 1539 B6R1.2 Cl[C@@H]1CCNC1 MCULE-7223308304 [0,0,0,1,0,0|2,0,0]=3 1540 B6R1.2 Cl[C@@H]1CCNC1 MCULE-9699335522 [0,0,0,1,0,0|2,0,0]=3 1541 B6R1.2 Cl[C@H]1CCNC1 MCULE-1696981588 [0,0,0,1,0,0|2,0,0]=3 1542 B6R1.2 Cl[C@H]1CCNC1 MCULE-4535592624 [0,0,0,1,0,0|2,0,0]=3 1543 B6R1.2 Cl[C@H]1CCNC1 MCULE-4850151938 [0,0,0,1,0,0|2,0,0]=3 1544 B6R1.2 Cl[C@H]1CCNC1 MCULE-8947782807 [0,0,0,1,0,0|2,0,0]=3 1545 B6R1.2 FC1CCCC1 MCULE-1416016970 [0,0,0,1,0,0|2,0,0]=3 1546 B6R1.2 FC1CCNC1 MCULE-3601135445 [0,0,0,1,0,0|2,0,0]=3 1547 B6R1.2 FC1CCNC1 MCULE-8578750940 [0,0,0,1,0,0|2,0,0]=3 1548 B6R1.2 FC1CNOC1 MCULE-4837734523 [0,0,0,1,0,0|2,0,0]=3 1549 B6R1.2 FC1CNOC1 MCULE-6176254900 [0,0,0,1,0,0|2,0,0]=3 1550 B6R1.2 F[C@@H]1CCNC1 MCULE-4408739710 [0,0,0,1,0,0|2,0,0]=3 1551 B6R1.2 F[C@@H]1CCNC1 MCULE-5678498844 [0,0,0,1,0,0|2,0,0]=3 1552 B6R1.2 F[C@@H]1CCNC1 MCULE-5679054116 [0,0,0,1,0,0|2,0,0]=3 1553 B6R1.2 F[C@@H]1CCNC1 MCULE-7029204180 [0,0,0,1,0,0|2,0,0]=3 1554 B6R1.2 F[C@H]1CCCN1 MCULE-8612757365 [0,0,0,1,0,0|3,0,0]=4 1555 B6R1.2 F[C@H]1CCNC1 MCULE-2854402872 [0,0,0,1,0,0|2,0,0]=3 1556 B6R1.2 F[C@H]1CCNC1 MCULE-4493640982 [0,0,0,1,0,0|2,0,0]=3 1557 B6R1.2 F[C@H]1CCNC1 MCULE-7441383471 [0,0,0,1,0,0|2,0,0]=3 1558 B6R1.2 F[C@H]1CCNC1 MCULE-7946601643 [0,0,0,1,0,0|2,0,0]=3 1559 B6R1.2 IC1=COCC1 MCULE-3076361502 [0,0,0,1,0,0|1,0,2]=4 1560 B6R1.2 IC1CCCC1 MCULE-2705379744 [0,0,0,1,0,0|2,0,0]=3 1561 B6R1.2 IC1CCNC1 MCULE-3058541551 [0,0,0,1,0,0|2,0,0]=3 1562 B6R1.2 IC1CCNC1 MCULE-5326267139 [0,0,0,1,0,0|2,0,0]=3 1563 B6R1.2 IC1CCOC1 MCULE-1379775972 [0,0,0,1,0,0|1,0,0]=2 1564 B6R1.2 I[C@@H]1CCNC1 MCULE-3800433724 [0,0,0,1,0,0|2,0,0]=3 1565 B6R1.2 I[C@@H]1CCNC1 MCULE-3857825133 [0,0,0,1,0,0|2,0,0]=3 1566 B6R1.2 I[C@@H]1CCNC1 MCULE-7781267462 [0,0,0,1,0,0|2,0,0]=3 1567 B6R1.2 I[C@@H]1CCNC1 MCULE-7979843810 [0,0,0,1,0,0|2,0,0]=3 1568 B6R1.2 I[C@@H]1CCOC1 MCULE-2036157502 [0,0,0,1,0,0|1,0,0]=2 1569 B6R1.2 I[C@@H]1CCOC1 MCULE-4800752659 [0,0,0,1,0,0|1,0,0]=2 1570 B6R1.2 I[C@H]1CCNC1 MCULE-1218289403 [0,0,0,1,0,0|2,0,0]=3 1571 B6R1.2 I[C@H]1CCNC1 MCULE-7469922084 [0,0,0,1,0,0|2,0,0]=3 1572 B6R1.2 I[C@H]1CCOC1 MCULE-4242860607 [0,0,0,1,0,0|1,0,0]=2 1573 B6R1.2 I[C@H]1CCOC1 MCULE-7095404975 [0,0,0,1,0,0|1,0,0]=2 1574 B6R1.2 NC1=NCCO1 MCULE-1257431295 [0,0,0,1,0,0|2,0,1]=4 1575 B6R1.2 NC1=NCCO1 MCULE-9912511107 [0,0,0,1,0,0|2,0,1]=4 1576 B6R1.2 NC1=NOCC1 MCULE-4971355735 [0,0,0,1,0,0|2,0,1]=4 1577 B6R1.2 NC1C=CCC1 MCULE-2537724380 [0,0,0,1,0,0|2,0,1]=4 1578 B6R1.2 NC1C=CCC1 MCULE-5017993489 [0,0,0,1,0,0|2,0,1]=4 1579 B6R1.2 NC1CC=CC1 MCULE-3815719332 [0,0,0,1,0,0|2,0,1]=4 1580 B6R1.2 NC1CC=CC1 MCULE-9984030144 [0,0,0,1,0,0|2,0,1]=4 1581 B6R1.2 NC1CCCC1 MCULE-2292038009 [0,0,0,1,0,0|2,0,0]=3 1582 B6R1.2 NC1CCNC1 MCULE-2237528072 [0,0,0,1,0,0|2,0,0]=3 1583 B6R1.2 NC1CCNC1 MCULE-5167920547 [0,0,0,1,0,0|2,0,0]=3 1584 B6R1.2 NC1CCNC1 MCULE-5837785719 [0,0,0,1,0,0|2,0,0]=3 1585 B6R1.2 NC1CCOC1 MCULE-1276945018 [0,0,0,1,0,0|1,0,0]=2 1586 B6R1.2 NC1CCOC1 MCULE-8146259495 [0,0,0,1,0,0|1,0,0]=2 1587 B6R1.2 NC1CCSC1 MCULE-8972229387 [0,0,0,1,0,0|1,1,0]=3 1588 B6R1.2 NC1CCSC1 MCULE-9186640582 [0,0,0,1,0,0|1,1,0]=3 1589 B6R1.2 NC1CSSC1 MCULE-4887591316 [0,0,0,1,0,0|2,1,0]=4 1590 B6R1.2 NC1CSSC1 MCULE-5524609325 [0,0,0,1,0,0|2,1,0]=4 1591 B6R1.2 NC1CSSC1 MCULE-9014844047 [0,0,0,1,0,0|2,1,0]=4 1592 B6R1.2 NN1CCCC1 MCULE-1562593919 [0,0,0,1,0,0|3,0,0]=4 1593 B6R1.2 NN1CCCC1 MCULE-2311855036 [0,0,0,1,0,0|3,0,0]=4 1594 B6R1.2 NN1CCCC1 MCULE-5484008222 [0,0,0,1,0,0|3,0,0]=4 1595 B6R1.2 N[C@@H]1CCNC1 MCULE-6043697974 [0,0,0,1,0,0|2,0,0]=3 1596 B6R1.2 N[C@@H]1CCNC1 MCULE-8912264932 [0,0,0,1,0,0|2,0,0]=3 1597 B6R1.2 N[C@@H]1CCNC1 MCULE-9183647019 [0,0,0,1,0,0|2,0,0]=3 1598 B6R1.2 N[C@@H]1CCNC1 MCULE-9608760183 [0,0,0,1,0,0|2,0,0]=3 1599 B6R1.2 N[C@@H]1CCOC1 MCULE-1100136080 [0,0,0,1,0,0|1,0,0]=2 1600 B6R1.2 N[C@@H]1CCOC1 MCULE-4493278911 [0,0,0,1,0,0|1,0,0]=2 1601 B6R1.2 N[C@@H]1CCOC1 MCULE-5574536510 [0,0,0,1,0,0|1,0,0]=2 1602 B6R1.2 N[C@@H]1CCOC1 MCULE-7204677203 [0,0,0,1,0,0|1,0,0]=2 1603 B6R1.2 N[C@H]1CCNC1 MCULE-3573455998 [0,0,0,1,0,0|2,0,0]=3 1604 B6R1.2 N[C@H]1CCNC1 MCULE-3988158945 [0,0,0,1,0,0|2,0,0]=3 1605 B6R1.2 N[C@H]1CCNC1 MCULE-4526890579 [0,0,0,1,0,0|2,0,0]=3 1606 B6R1.2 N[C@H]1CCNC1 MCULE-8548728927 [0,0,0,1,0,0|2,0,0]=3 1607 B6R1.2 N[C@H]1CCOC1 MCULE-2273771439 [0,0,0,1,0,0|1,0,0]=2 1608 B6R1.2 N[C@H]1CCOC1 MCULE-3567904137 [0,0,0,1,0,0|1,0,0]=2 1609 B6R1.2 N[C@H]1CCOC1 MCULE-5268616156 [0,0,0,1,0,0|1,0,0]=2 1610 B6R1.2 N[C@H]1CCOC1 MCULE-7351975857 [0,0,0,1,0,0|1,0,0]=2 1611 B6R1.2 O=C1CCCC1 MCULE-9455227735 [0,0,0,1,0,0|1,0,2]=4 1612 B6R1.2 O=C1CCCO1 MCULE-6795890265 [0,0,0,1,0,0|2,0,1]=4 1613 B6R1.2 O=C1CCNC1 MCULE-2947789259 [0,0,0,1,0,0|1,0,2]=4 1614 B6R1.2 O=C1CCNC1 MCULE-7192595052 [0,0,0,1,0,0|1,0,2]=4 1615 B6R1.2 O=C1CCOC1 MCULE-2031733910 [0,0,0,1,0,0|0,0,2]=3 1616 B6R1.2 O=C1CCON1 MCULE-6799359324 [0,0,0,1,0,0|1,0,2]=4 1617 B6R1.2 O=C1CCSC1 MCULE-2059655624 [0,0,0,1,0,0|0,1,2]=4 1618 B6R1.2 O=C1NCCO1 MCULE-3934923008 [0,0,0,1,0,0|2,0,1]=4 1619 B6R1.2 O=C1OCCO1 MCULE-9493253045 [0,0,0,1,0,0|1,0,1]=3 1620 B6R1.2 O=S1CCCC1 MCULE-2442126780 [0,0,0,1,0,0|2,0,1]=4 1621 B6R1.2 O=S1OCCO1 MCULE-5773173321 [0,0,0,1,0,0|2,0,0]=3 1622 B6R1.2 OC1C=CCC1 MCULE-3857764876 [0,0,0,1,0,0|1,0,1]=3 1623 B6R1.2 OC1C=CCO1 MCULE-4636930669 [0,0,0,1,0,0|2,0,1]=4 1624 B6R1.2 OC1CC=CC1 MCULE-6176562196 [0,0,0,1,0,0|1,0,1]=3 1625 B6R1.2 OC1CCCC1 MCULE-1758440264 [0,0,0,1,0,0|1,0,0]=2 1626 B6R1.2 OC1CCCN1 MCULE-4787168972 [0,0,0,1,0,0|2,0,0]=3 1627 B6R1.2 OC1CCCO1 MCULE-9632627344 [0,0,0,1,0,0|2,0,0]=3 1628 B6R1.2 OC1CCNC1 MCULE-4307402606 [0,0,0,1,0,0|1,0,0]=2 1629 B6R1.2 OC1CCNC1 MCULE-6745480350 [0,0,0,1,0,0|1,0,0]=2 1630 B6R1.2 OC1CCOC1 MCULE-4469581028 [0,0,0,1,0,0|0,0,0]=1 1631 B6R1.2 OC1CCSC1 MCULE-9796808599 [0,0,0,1,0,0|0,1,0]=2 1632 B6R1.2 OC1CNOC1 MCULE-3414700581 [0,0,0,1,0,0|1,0,0]=2 1633 B6R1.2 OC1CNOC1 MCULE-8163403090 [0,0,0,1,0,0|1,0,0]=2 1634 B6R1.2 OC1CNOC1 MCULE-8644852072 [0,0,0,1,0,0|1,0,0]=2 1635 B6R1.2 OC1C[NH2+]OC1 MCULE-7865131527 [0,0,0,1,0,0|1,0,0]=2 1636 B6R1.2 O[C@@H]1CCNC1 MCULE-8116497337 [0,0,0,1,0,0|1,0,0]=2 1637 B6R1.2 O[C@@H]1CCNC1 MCULE-8578068948 [0,0,0,1,0,0|1,0,0]=2 1638 B6R1.2 O[C@@H]1CCNC1 MCULE-9094582248 [0,0,0,1,0,0|1,0,0]=2 1639 B6R1.2 O[C@@H]1CCNC1 MCULE-9933593352 [0,0,0,1,0,0|1,0,0]=2 1640 B6R1.2 O[C@@H]1CCOC1 MCULE-7739141732 [0,0,0,1,0,0|0,0,0]=1 1641 B6R1.2 O[C@@H]1CCOC1 MCULE-8344812226 [0,0,0,1,0,0|0,0,0]=1 1642 B6R1.2 O[C@@H]1CCOC1 MCULE-9098074990 [0,0,0,1,0,0|0,0,0]=1 1643 B6R1.2 O[C@@H]1CCSC1 MCULE-3532754705 [0,0,0,1,0,0|0,1,0]=2 1644 B6R1.2 O[C@@H]1CCSC1 MCULE-5800407146 [0,0,0,1,0,0|0,1,0]=2 1645 B6R1.2 O[C@@H]1CNOC1 MCULE-1481945185 [0,0,0,1,0,0|1,0,0]=2 1646 B6R1.2 O[C@@H]1CNOC1 MCULE-4156521353 [0,0,0,1,0,0|1,0,0]=2 1647 B6R1.2 O[C@@H]1CNOC1 MCULE-5692816168 [0,0,0,1,0,0|1,0,0]=2 1648 B6R1.2 O[C@@H]1CNOC1 MCULE-6838604903 [0,0,0,1,0,0|1,0,0]=2 1649 B6R1.2 O[C@H]1CCNC1 MCULE-1100098088 [0,0,0,1,0,0|1,0,0]=2 1650 B6R1.2 O[C@H]1CCNC1 MCULE-3493644065 [0,0,0,1,0,0|1,0,0]=2 1651 B6R1.2 O[C@H]1CCNC1 MCULE-3778918259 [0,0,0,1,0,0|1,0,0]=2 1652 B6R1.2 O[C@H]1CCNC1 MCULE-4680162054 [0,0,0,1,0,0|1,0,0]=2 1653 B6R1.2 O[C@H]1CCOC1 MCULE-8518846297 [0,0,0,1,0,0|0,0,0]=1 1654 B6R1.2 O[C@H]1CCOC1 MCULE-9544747995 [0,0,0,1,0,0|0,0,0]=1 1655 B6R1.2 O[C@H]1CNOC1 MCULE-1746817114 [0,0,0,1,0,0|1,0,0]=2 1656 B6R1.2 O[C@H]1CNOC1 MCULE-4469396812 [0,0,0,1,0,0|1,0,0]=2 1657 B6R1.2 O[C@H]1CNOC1 MCULE-7167785164 [0,0,0,1,0,0|1,0,0]=2 1658 B6R1.2 O[C@H]1CNOC1 MCULE-8409877332 [0,0,0,1,0,0|1,0,0]=2 1659 B6R1.2 P1(=O)OCCO1 MCULE-3753821837 [0,0,0,1,0,0|2,0,0]=3 1660 B6R1.2 SC1=NCCO1 MCULE-6684545723 [0,0,0,1,0,0|2,0,1]=4 1661 B6R1.2 SC1CCCC1 MCULE-5932400506 [0,0,0,1,0,0|1,1,0]=3 1662 B6R1.2 SC1CCOC1 MCULE-9247906418 [0,0,0,1,0,0|0,1,0]=2 1663 B6R1.2 SC1CCSC1 MCULE-5955380477 [0,0,0,1,0,0|0,2,0]=3 1664 B6R1.2 [NH3+]C1CC[NH2+]C1 MCULE-3374468196 [0,0,0,1,0,0|2,0,0]=3 1665 B6R1.3 BrCCC1CC1 MCULE-3454213225 [0,0,0,1,0,0|2,0,0]=3 1666 B6R1.3 BrCCC1CO1 MCULE-9889314000 [0,0,0,1,0,0|2,0,0]=3 1667 B6R1.3 BrCC[C@@H]1CO1 MCULE-7015242723 [0,0,0,1,0,0|2,0,0]=3 1668 B6R1.3 BrCC[C@H]1CO1 MCULE-3286755305 [0,0,0,1,0,0|2,0,0]=3 1669 B6R1.3 BrCC[C@H]1CO1 MCULE-3512143037 [0,0,0,1,0,0|2,0,0]=3 1670 B6R1.3 C#CCC1CC1 MCULE-4980990503 [0,0,0,1,0,0|2,0,1]=4 1671 B6R1.3 CC#CC1CC1 MCULE-8441018700 [0,0,0,1,0,0|2,0,1]=4 1672 B6R1.3 CCCC1CO1 MCULE-5080039224 [0,0,0,1,0,0|1,0,0]=2 1673 B6R1.3 CCC[C@@H]1CO1 MCULE-1815222100 [0,0,0,1,0,0|1,0,0]=2 1674 B6R1.3 CCC[C@H]1CO1 MCULE-9952368131 [0,0,0,1,0,0|1,0,0]=2 1675 B6R1.3 CCNC1CC1 MCULE-6542327880 [0,0,0,1,0,0|2,0,0]=3 1676 B6R1.3 CCNC1CC1 MCULE-6804557809 [0,0,0,1,0,0|2,0,0]=3 1677 B6R1.3 CCNC1CC1 MCULE-7846800898 [0,0,0,1,0,0|2,0,0]=3 1678 B6R1.3 CNCC1CC1 MCULE-4410938050 [0,0,0,1,0,0|3,0,0]=4 1679 B6R1.3 CNCC1CC1 MCULE-6365201280 [0,0,0,1,0,0|3,0,0]=4 1680 B6R1.3 COCC1CO1 MCULE-3193889854 [0,0,0,1,0,0|2,0,0]=3 1681 B6R1.3 COC[C@@H]1CO1 MCULE-8086795507 [0,0,0,1,0,0|2,0,0]=3 1682 B6R1.3 COC[C@@H]1CO1 MCULE-8921875584 [0,0,0,1,0,0|2,0,0]=3 1683 B6R1.3 COC[C@H]1CO1 MCULE-7210190703 [0,0,0,1,0,0|2,0,0]=3 1684 B6R1.3 COC[C@H]1CO1 MCULE-8979404390 [0,0,0,1,0,0|2,0,0]=3 1685 B6R1.3 CONC1CC1 MCULE-3903074552 [0,0,0,1,0,0|3,0,0]=4 1686 B6R1.3 CONC1CC1 MCULE-6248549552 [0,0,0,1,0,0|3,0,0]=4 1687 B6R1.3 CSCC1CO1 MCULE-9014850650 [0,0,0,1,0,0|2,0,0]=3 1688 B6R1.3 ClCCC1CC1 MCULE-5665496795 [0,0,0,1,0,0|2,0,0]=3 1689 B6R1.3 ClCCC1CO1 MCULE-2772510260 [0,0,0,1,0,0|2,0,0]=3 1690 B6R1.3 ICCC1CC1 MCULE-5518738700 [0,0,0,1,0,0|2,0,0]=3 1691 B6R1.3 N#CCC1CC1 MCULE-4951047709 [0,0,0,1,0,0|2,0,1]=4 1692 B6R1.3 NCCC1CC1 MCULE-8459735325 [0,0,0,1,0,0|2,0,0]=3 1693 B6R1.3 NCCC1CC1 MCULE-9646218986 [0,0,0,1,0,0|2,0,0]=3 1694 B6R1.3 NCCN1CC1 MCULE-3554584147 [0,0,0,1,0,0|2,0,0]=3 1695 B6R1.3 NNCC1CC1 MCULE-4020404918 [0,0,0,1,0,0|3,0,0]=4 1696 B6R1.3 NNCC1CC1 MCULE-7742306770 [0,0,0,1,0,0|3,0,0]=4 1697 B6R1.3 NNCC1CC1 MCULE-8978618772 [0,0,0,1,0,0|3,0,0]=4 1698 B6R1.3 NOCC1CC1 MCULE-3594146552 [0,0,0,1,0,0|3,0,0]=4 1699 B6R1.3 NOCC1CC1 MCULE-7376211865 [0,0,0,1,0,0|3,0,0]=4 1700 B6R1.3 O=CCC1CC1 MCULE-3319649937 [0,0,0,1,0,0|1,0,2]=4 1701 B6R1.3 OCCC1CC1 MCULE-1360348684 [0,0,0,1,0,0|1,0,0]=2 1702 B6R1.3 OCCC1CO1 MCULE-6523000607 [0,0,0,1,0,0|2,0,0]=3 1703 B6R1.3 OCCN1CC1 MCULE-3845187783 [0,0,0,1,0,0|1,0,0]=2 1704 B6R1.3 OCC[C@@H]1CO1 MCULE-4797533590 [0,0,0,1,0,0|2,0,0]=3 1705 B6R1.3 OCC[C@@H]1CO1 MCULE-6833850805 [0,0,0,1,0,0|2,0,0]=3 1706 B6R1.3 OCC[C@H]1CO1 MCULE-3560802495 [0,0,0,1,0,0|2,0,0]=3 1707 B6R1.3 OCC[C@H]1CO1 MCULE-8738926598 [0,0,0,1,0,0|2,0,0]=3 1708 B6R1.4 CC1CCC1=O MCULE-4548181715 [0,0,0,1,0,0|1,0,2]=4 1709 B6R1.4 CC1CCC1N MCULE-9634057678 [0,0,0,1,0,0|2,0,0]=3 1710 B6R1.4 CC1CCC1N MCULE-9849489304 [0,0,0,1,0,0|2,0,0]=3 1711 B6R1.4 CC1CCC1O MCULE-3852133104 [0,0,0,1,0,0|1,0,0]=2 1712 B6R1.4 CC1CNC1C MCULE-6217110869 [0,0,0,1,0,0|2,0,0]=3 1713 B6R1.4 CC1CNC1C MCULE-8966220604 [0,0,0,1,0,0|2,0,0]=3 1714 B6R1.4 CC1COC1=O MCULE-9711165188 [0,0,0,1,0,0|2,0,1]=4 1715 B6R1.4 CC1NCC1F MCULE-2205876595 [0,0,0,1,0,0|2,0,0]=3 1716 B6R1.4 CC1NCC1F MCULE-3575637458 [0,0,0,1,0,0|2,0,0]=3 1717 B6R1.4 CC1NCC1O MCULE-6512695808 [0,0,0,1,0,0|1,0,0]=2 1718 B6R1.4 CC1NCC1O MCULE-8357296054 [0,0,0,1,0,0|1,0,0]=2 1719 B6R1.4 CC1OCC1=O MCULE-7718609686 [0,0,0,1,0,0|0,0,2]=3 1720 B6R1.4 CC1OCC1O MCULE-1893283492 [0,0,0,1,0,0|0,0,0]=1 1721 B6R1.4 C[C@@H]1CC[C@@H]1N MCULE-9803413081 [0,0,0,1,0,0|2,0,0]=3 1722 B6R1.4 C[C@@H]1CC[C@H]1N MCULE-3888655890 [0,0,0,1,0,0|2,0,0]=3 1723 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-5099590573 [0,0,0,1,0,0|2,0,0]=3 1724 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-6754257002 [0,0,0,1,0,0|2,0,0]=3 1725 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-7084262632 [0,0,0,1,0,0|2,0,0]=3 1726 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-9147724667 [0,0,0,1,0,0|2,0,0]=3 1727 B6R1.4 C[C@@H]1NC[C@@H]1F MCULE-2104999017 [0,0,0,1,0,0|2,0,0]=3 1728 B6R1.4 C[C@@H]1NC[C@@H]1F MCULE-9859591204 [0,0,0,1,0,0|2,0,0]=3 1729 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-1528414534 [0,0,0,1,0,0|1,0,0]=2 1730 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-2910306067 [0,0,0,1,0,0|1,0,0]=2 1731 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-3197698089 [0,0,0,1,0,0|1,0,0]=2 1732 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-3295326997 [0,0,0,1,0,0|1,0,0]=2 1733 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-5640695802 [0,0,0,1,0,0|1,0,0]=2 1734 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-7598216076 [0,0,0,1,0,0|1,0,0]=2 1735 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-2384338566 [0,0,0,1,0,0|2,0,0]=3 1736 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-3761027062 [0,0,0,1,0,0|2,0,0]=3 1737 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-7625337051 [0,0,0,1,0,0|2,0,0]=3 1738 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-8482078532 [0,0,0,1,0,0|2,0,0]=3 1739 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3152396704 [0,0,0,1,0,0|1,0,0]=2 1740 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3248209918 [0,0,0,1,0,0|1,0,0]=2 1741 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3575939824 [0,0,0,1,0,0|1,0,0]=2 1742 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-4120662394 [0,0,0,1,0,0|1,0,0]=2 1743 B6R1.4 C[C@H]1CC[C@@H]1N MCULE-1445146965 [0,0,0,1,0,0|2,0,0]=3 1744 B6R1.4 C[C@H]1CC[C@H]1N MCULE-3329522369 [0,0,0,1,0,0|2,0,0]=3 1745 B6R1.4 C[C@H]1NC[C@@H]1F MCULE-6266484815 [0,0,0,1,0,0|2,0,0]=3 1746 B6R1.4 C[C@H]1NC[C@@H]1F MCULE-9525975864 [0,0,0,1,0,0|2,0,0]=3 1747 B6R1.4 C[C@H]1NC[C@@H]1O MCULE-3510002118 [0,0,0,1,0,0|1,0,0]=2 1748 B6R1.4 C[C@H]1NC[C@@H]1O MCULE-6901722671 [0,0,0,1,0,0|1,0,0]=2 1749 B6R1.4 C[C@H]1NC[C@H]1F MCULE-6303998999 [0,0,0,1,0,0|2,0,0]=3 1750 B6R1.4 C[C@H]1NC[C@H]1F MCULE-8897044344 [0,0,0,1,0,0|2,0,0]=3 1751 B6R1.4 C[C@H]1NC[C@H]1O MCULE-1733557375 [0,0,0,1,0,0|1,0,0]=2 1752 B6R1.4 C[C@H]1NC[C@H]1O MCULE-3026150373 [0,0,0,1,0,0|1,0,0]=2 1753 B6R1.4 C[C@H]1NC[C@H]1O MCULE-7386387747 [0,0,0,1,0,0|1,0,0]=2 1754 B6R1.4 C[C@H]1NC[C@H]1O MCULE-7405032693 [0,0,0,1,0,0|1,0,0]=2 1755 B6R1.4 NC1CCC1F MCULE-1403984623 [0,0,0,1,0,0|3,0,0]=4 1756 B6R1.4 NC1CCC1F MCULE-8216841286 [0,0,0,1,0,0|3,0,0]=4 1757 B6R1.4 NC1CCC1N MCULE-6052332328 [0,0,0,1,0,0|3,0,0]=4 1758 B6R1.4 NC1CCC1O MCULE-4636397534 [0,0,0,1,0,0|2,0,0]=3 1759 B6R1.4 NC1CCC1O MCULE-7148132261 [0,0,0,1,0,0|2,0,0]=3 1760 B6R1.4 NC1COC1=O MCULE-6998565452 [0,0,0,1,0,0|2,0,1]=4 1761 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-1054283097 [0,0,0,1,0,0|2,0,0]=3 1762 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-3905992171 [0,0,0,1,0,0|2,0,0]=3 1763 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-6111990015 [0,0,0,1,0,0|2,0,0]=3 1764 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-9101755956 [0,0,0,1,0,0|2,0,0]=3 1765 B6R1.4 N[C@@H]1CC[C@H]1N MCULE-6204977772 [0,0,0,1,0,0|3,0,0]=4 1766 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-1883601377 [0,0,0,1,0,0|2,0,0]=3 1767 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-6045787726 [0,0,0,1,0,0|2,0,0]=3 1768 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-7120290402 [0,0,0,1,0,0|2,0,0]=3 1769 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-8603369729 [0,0,0,1,0,0|2,0,0]=3 1770 B6R1.4 N[C@@H]1COC1=O MCULE-8080548213 [0,0,0,1,0,0|2,0,1]=4 1771 B6R1.4 N[C@@H]1COC1=O MCULE-9370092691 [0,0,0,1,0,0|2,0,1]=4 1772 B6R1.4 N[C@H]1CC[C@@H]1N MCULE-3551063683 [0,0,0,1,0,0|3,0,0]=4 1773 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-1761694918 [0,0,0,1,0,0|2,0,0]=3 1774 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-2828590958 [0,0,0,1,0,0|2,0,0]=3 1775 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-3261752057 [0,0,0,1,0,0|2,0,0]=3 1776 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-7711512049 [0,0,0,1,0,0|2,0,0]=3 1777 B6R1.4 N[C@H]1CC[C@H]1N MCULE-2823061893 [0,0,0,1,0,0|3,0,0]=4 1778 B6R1.4 N[C@H]1CC[C@H]1N MCULE-6752412872 [0,0,0,1,0,0|3,0,0]=4 1779 B6R1.4 N[C@H]1CC[C@H]1O MCULE-3204268809 [0,0,0,1,0,0|2,0,0]=3 1780 B6R1.4 N[C@H]1CC[C@H]1O MCULE-4184135738 [0,0,0,1,0,0|2,0,0]=3 1781 B6R1.4 N[C@H]1COC1=O MCULE-4812631526 [0,0,0,1,0,0|2,0,1]=4 1782 B6R1.4 O=C1CCC1O MCULE-1248327203 [0,0,0,1,0,0|2,0,1]=4 1783 B6R1.4 OC1CCC1O MCULE-3286787157 [0,0,0,1,0,0|2,0,0]=3 1784 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-5060593050 [0,0,0,1,0,0|2,0,0]=3 1785 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-6357622033 [0,0,0,1,0,0|2,0,0]=3 1786 B6R1.4 O[C@H]1CC[C@H]1O MCULE-7964152901 [0,0,0,1,0,0|2,0,0]=3 1787 B6R1.4 [C@@H]1(COC1=O)N MCULE-7456320845 [0,0,0,1,0,0|2,0,1]=4 1788 B6R1.6 BrCC1CCC1 MCULE-6307620219 [0,0,0,1,0,0|2,0,0]=3 1789 B6R1.6 BrCC1CCO1 MCULE-8997197221 [0,0,0,1,0,0|1,0,0]=2 1790 B6R1.6 BrCC1CNC1 MCULE-5889797727 [0,0,0,1,0,0|3,0,0]=4 1791 B6R1.6 BrCC1CNC1 MCULE-7668948015 [0,0,0,1,0,0|3,0,0]=4 1792 B6R1.6 BrCC1COC1 MCULE-3267235863 [0,0,0,1,0,0|3,0,0]=4 1793 B6R1.6 BrC[C@@H]1CCO1 MCULE-5332541596 [0,0,0,1,0,0|1,0,0]=2 1794 B6R1.6 BrC[C@H]1CCO1 MCULE-4327725094 [0,0,0,1,0,0|1,0,0]=2 1795 B6R1.6 BrC[C@H]1CCO1 MCULE-5319595119 [0,0,0,1,0,0|1,0,0]=2 1796 B6R1.6 C#CC1CCC1 MCULE-3076610847 [0,0,0,1,0,0|2,0,1]=4 1797 B6R1.6 C#CC1CCN1 MCULE-4919064001 [0,0,0,1,0,0|2,0,1]=4 1798 B6R1.6 C#CC1CCN1 MCULE-9869131517 [0,0,0,1,0,0|2,0,1]=4 1799 B6R1.6 C#CC1CCO1 MCULE-6571223458 [0,0,0,1,0,0|1,0,1]=3 1800 B6R1.6 C1(CCN1)CO MCULE-6309114010 [0,0,0,1,0,0|1,0,0]=2 1801 B6R1.6 CCC1CCN1 MCULE-2791335818 [0,0,0,1,0,0|2,0,0]=3 1802 B6R1.6 CCC1CCN1 MCULE-3929810240 [0,0,0,1,0,0|2,0,0]=3 1803 B6R1.6 CCC1CNC1 MCULE-5314495230 [0,0,0,1,0,0|3,0,0]=4 1804 B6R1.6 CCC1CNC1 MCULE-6675770601 [0,0,0,1,0,0|3,0,0]=4 1805 B6R1.6 CNC1CCC1 MCULE-1364608179 [0,0,0,1,0,0|3,0,0]=4 1806 B6R1.6 CNC1CCC1 MCULE-2951993315 [0,0,0,1,0,0|3,0,0]=4 1807 B6R1.6 CNC1CCN1 MCULE-7769870554 [0,0,0,1,0,0|3,0,0]=4 1808 B6R1.6 CNC1CCN1 MCULE-9764026934 [0,0,0,1,0,0|3,0,0]=4 1809 B6R1.6 ClCC1CCC1 MCULE-2464596839 [0,0,0,1,0,0|2,0,0]=3 1810 B6R1.6 ClCC1CCO1 MCULE-3809712491 [0,0,0,1,0,0|1,0,0]=2 1811 B6R1.6 ClCC1CNC1 MCULE-2451543932 [0,0,0,1,0,0|3,0,0]=4 1812 B6R1.6 ClCC1CNC1 MCULE-9626195989 [0,0,0,1,0,0|3,0,0]=4 1813 B6R1.6 ClCC1COC1 MCULE-1144637548 [0,0,0,1,0,0|3,0,0]=4 1814 B6R1.6 FCC1CCN1 MCULE-1368993155 [0,0,0,1,0,0|2,0,0]=3 1815 B6R1.6 FCC1CCN1 MCULE-8515014805 [0,0,0,1,0,0|2,0,0]=3 1816 B6R1.6 FCC1CCN1 MCULE-9723993015 [0,0,0,1,0,0|2,0,0]=3 1817 B6R1.6 FCC1CNC1 MCULE-4813599184 [0,0,0,1,0,0|3,0,0]=4 1818 B6R1.6 FCC1CNC1 MCULE-5694626686 [0,0,0,1,0,0|3,0,0]=4 1819 B6R1.6 FC[C@@H]1CCN1 MCULE-3863169127 [0,0,0,1,0,0|2,0,0]=3 1820 B6R1.6 FC[C@@H]1CCN1 MCULE-6069828502 [0,0,0,1,0,0|2,0,0]=3 1821 B6R1.6 FC[C@@H]1CCN1 MCULE-7267455157 [0,0,0,1,0,0|2,0,0]=3 1822 B6R1.6 FC[C@@H]1CCN1 MCULE-8157561423 [0,0,0,1,0,0|2,0,0]=3 1823 B6R1.6 FC[C@H]1CCN1 MCULE-3092369600 [0,0,0,1,0,0|2,0,0]=3 1824 B6R1.6 FC[C@H]1CCN1 MCULE-6708783004 [0,0,0,1,0,0|2,0,0]=3 1825 B6R1.6 ICC1CCC1 MCULE-7767711699 [0,0,0,1,0,0|2,0,0]=3 1826 B6R1.6 ICC1CCO1 MCULE-4132798336 [0,0,0,1,0,0|1,0,0]=2 1827 B6R1.6 ICC1COC1 MCULE-6325029437 [0,0,0,1,0,0|3,0,0]=4 1828 B6R1.6 N#CC1CCC1 MCULE-3335810526 [0,0,0,1,0,0|2,0,1]=4 1829 B6R1.6 N#CC1CCN1 MCULE-1911621774 [0,0,0,1,0,0|2,0,1]=4 1830 B6R1.6 N#CC1CCN1 MCULE-4794260273 [0,0,0,1,0,0|2,0,1]=4 1831 B6R1.6 N#CC1CCN1 MCULE-9823982389 [0,0,0,1,0,0|2,0,1]=4 1832 B6R1.6 N#C[C@@H]1CCN1 MCULE-1138328452 [0,0,0,1,0,0|2,0,1]=4 1833 B6R1.6 N#C[C@@H]1CCN1 MCULE-5332905379 [0,0,0,1,0,0|2,0,1]=4 1834 B6R1.6 N#C[C@@H]1CCN1 MCULE-6157011731 [0,0,0,1,0,0|2,0,1]=4 1835 B6R1.6 N#C[C@@H]1CCN1 MCULE-8276413658 [0,0,0,1,0,0|2,0,1]=4 1836 B6R1.6 N#C[C@H]1CCN1 MCULE-1867811844 [0,0,0,1,0,0|2,0,1]=4 1837 B6R1.6 N#C[C@H]1CCN1 MCULE-2164621620 [0,0,0,1,0,0|2,0,1]=4 1838 B6R1.6 N#C[C@H]1CCN1 MCULE-7854885202 [0,0,0,1,0,0|2,0,1]=4 1839 B6R1.6 N#C[C@H]1CCN1 MCULE-8486466797 [0,0,0,1,0,0|2,0,1]=4 1840 B6R1.6 N#C[C@H]1CCN1 MCULE-9219109892 [0,0,0,1,0,0|2,0,1]=4 1841 B6R1.6 NCC1CCC1 MCULE-4977602211 [0,0,0,1,0,0|2,0,0]=3 1842 B6R1.6 NCC1CCC1 MCULE-8434128112 [0,0,0,1,0,0|2,0,0]=3 1843 B6R1.6 NCC1CCN1 MCULE-4988917629 [0,0,0,1,0,0|2,0,0]=3 1844 B6R1.6 NCC1CCN1 MCULE-5495577627 [0,0,0,1,0,0|2,0,0]=3 1845 B6R1.6 NCC1CCN1 MCULE-7749596260 [0,0,0,1,0,0|2,0,0]=3 1846 B6R1.6 NCC1CCO1 MCULE-4478591600 [0,0,0,1,0,0|1,0,0]=2 1847 B6R1.6 NCC1CCS1 MCULE-4026106833 [0,0,0,1,0,0|1,1,0]=3 1848 B6R1.6 NCC1CCS1 MCULE-5342015412 [0,0,0,1,0,0|1,1,0]=3 1849 B6R1.6 NCC1CNC1 MCULE-7601725567 [0,0,0,1,0,0|3,0,0]=4 1850 B6R1.6 NCC1CNC1 MCULE-7948891652 [0,0,0,1,0,0|3,0,0]=4 1851 B6R1.6 NCC1COC1 MCULE-4685637013 [0,0,0,1,0,0|3,0,0]=4 1852 B6R1.6 NCC1COC1 MCULE-6896653344 [0,0,0,1,0,0|3,0,0]=4 1853 B6R1.6 NCC1CSC1 MCULE-2317140221 [0,0,0,1,0,0|3,0,0]=4 1854 B6R1.6 NCC1CSC1 MCULE-2885312159 [0,0,0,1,0,0|3,0,0]=4 1855 B6R1.6 NC[C@@H]1CCO1 MCULE-2375359339 [0,0,0,1,0,0|1,0,0]=2 1856 B6R1.6 NC[C@@H]1CCO1 MCULE-4004256578 [0,0,0,1,0,0|1,0,0]=2 1857 B6R1.6 NC[C@H]1CCN1 MCULE-2270552795 [0,0,0,1,0,0|2,0,0]=3 1858 B6R1.6 NC[C@H]1CCN1 MCULE-2882990554 [0,0,0,1,0,0|2,0,0]=3 1859 B6R1.6 NC[C@H]1CCO1 MCULE-2811111103 [0,0,0,1,0,0|1,0,0]=2 1860 B6R1.6 NC[C@H]1CCO1 MCULE-4329808216 [0,0,0,1,0,0|1,0,0]=2 1861 B6R1.6 NC[C@H]1CCO1 MCULE-9974781002 [0,0,0,1,0,0|1,0,0]=2 1862 B6R1.6 NNC1CCC1 MCULE-2058855063 [0,0,0,1,0,0|3,0,0]=4 1863 B6R1.6 NNC1CCC1 MCULE-2355527907 [0,0,0,1,0,0|3,0,0]=4 1864 B6R1.6 NNC1CCC1 MCULE-7674249555 [0,0,0,1,0,0|3,0,0]=4 1865 B6R1.6 NOC1CCC1 MCULE-2140396646 [0,0,0,1,0,0|3,0,0]=4 1866 B6R1.6 NOC1CCC1 MCULE-9347173321 [0,0,0,1,0,0|3,0,0]=4 1867 B6R1.6 O=CC1CCC1 MCULE-8678026416 [0,0,0,1,0,0|1,0,2]=4 1868 B6R1.6 OCC1CCC1 MCULE-3046613150 [0,0,0,1,0,0|1,0,0]=2 1869 B6R1.6 OCC1CCN1 MCULE-1812443062 [0,0,0,1,0,0|1,0,0]=2 1870 B6R1.6 OCC1CCN1 MCULE-8390631765 [0,0,0,1,0,0|1,0,0]=2 1871 B6R1.6 OCC1CCO1 MCULE-7120761203 [0,0,0,1,0,0|0,0,0]=1 1872 B6R1.6 OCC1CCO1 MCULE-7517577386 [0,0,0,1,0,0|0,0,0]=1 1873 B6R1.6 OCC1CNC1 MCULE-1537874886 [0,0,0,1,0,0|2,0,0]=3 1874 B6R1.6 OCC1CNC1 MCULE-8316085177 [0,0,0,1,0,0|2,0,0]=3 1875 B6R1.6 OCC1COC1 MCULE-5031415478 [0,0,0,1,0,0|2,0,0]=3 1876 B6R1.6 OCC1CSC1 MCULE-9388221183 [0,0,0,1,0,0|2,0,0]=3 1877 B6R1.6 OC[C@@H]1CCN1 MCULE-5565957906 [0,0,0,1,0,0|1,0,0]=2 1878 B6R1.6 OC[C@@H]1CCN1 MCULE-7064010066 [0,0,0,1,0,0|1,0,0]=2 1879 B6R1.6 OC[C@@H]1CCN1 MCULE-7539121327 [0,0,0,1,0,0|1,0,0]=2 1880 B6R1.6 OC[C@@H]1CCN1 MCULE-9740096939 [0,0,0,1,0,0|1,0,0]=2 1881 B6R1.6 OC[C@@H]1CCO1 MCULE-7613449097 [0,0,0,1,0,0|0,0,0]=1 1882 B6R1.6 OC[C@@H]1CCO1 MCULE-9444003682 [0,0,0,1,0,0|0,0,0]=1 1883 B6R1.6 OC[C@H]1CCN1 MCULE-5733363493 [0,0,0,1,0,0|1,0,0]=2 1884 B6R1.6 OC[C@H]1CCN1 MCULE-8466413816 [0,0,0,1,0,0|1,0,0]=2 1885 B6R1.6 OC[C@H]1CCO1 MCULE-1446169257 [0,0,0,1,0,0|0,0,0]=1 1886 B6R1.6 OC[C@H]1CCO1 MCULE-2929052431 [0,0,0,1,0,0|0,0,0]=1 1887 B6R1.6 ON=C1CCC1 MCULE-4777625640 [0,0,0,1,0,0|2,0,1]=4 1888 B6R1.6 SCC1CCC1 MCULE-4083757063 [0,0,0,1,0,0|1,1,0]=3 1889 B6R1.6 SCC1COC1 MCULE-7193197469 [0,0,0,1,0,0|2,1,0]=4 1890 B6R1.8 C=C1CC1CO MCULE-4338601055 [0,0,0,1,0,0|1,0,2]=4 1891 B6R1.8 CC1CC1C#N MCULE-4373618430 [0,0,0,1,0,0|2,0,1]=4 1892 B6R1.8 CC1CC1C=O MCULE-2600627355 [0,0,0,1,0,0|1,0,2]=4 1893 B6R1.8 CC1CC1CN MCULE-2810102174 [0,0,0,1,0,0|2,0,0]=3 1894 B6R1.8 CC1CC1CN MCULE-7518062300 [0,0,0,1,0,0|2,0,0]=3 1895 B6R1.8 CC1CC1CO MCULE-5196594569 [0,0,0,1,0,0|1,0,0]=2 1896 B6R1.8 CC1OC1CBr MCULE-3133107383 [0,0,0,1,0,0|1,0,0]=2 1897 B6R1.8 CC1OC1CO MCULE-1680425960 [0,0,0,1,0,0|0,0,0]=1 1898 B6R1.8 CCC1CC1N MCULE-6304873051 [0,0,0,1,0,0|2,0,0]=3 1899 B6R1.8 CC[C@@H]1C[C@@H]1N MCULE-9218626187 [0,0,0,1,0,0|2,0,0]=3 1900 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-5365117215 [0,0,0,1,0,0|2,0,0]=3 1901 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-9993971387 [0,0,0,1,0,0|2,0,0]=3 1902 B6R1.8 CC[C@H]1C[C@@H]1N MCULE-5971477946 [0,0,0,1,0,0|2,0,0]=3 1903 B6R1.8 CC[C@H]1C[C@H]1N MCULE-4387456908 [0,0,0,1,0,0|2,0,0]=3 1904 B6R1.8 COC1CC1N MCULE-6836691149 [0,0,0,1,0,0|3,0,0]=4 1905 B6R1.8 COC1CC1N MCULE-9062056960 [0,0,0,1,0,0|3,0,0]=4 1906 B6R1.8 CO[C@@H]1C[C@@H]1N MCULE-6456572695 [0,0,0,1,0,0|3,0,0]=4 1907 B6R1.8 CO[C@@H]1C[C@@H]1N MCULE-9755300484 [0,0,0,1,0,0|3,0,0]=4 1908 B6R1.8 CO[C@@H]1C[C@H]1N MCULE-3862342520 [0,0,0,1,0,0|3,0,0]=4 1909 B6R1.8 CO[C@@H]1C[C@H]1N MCULE-4120361377 [0,0,0,1,0,0|3,0,0]=4 1910 B6R1.8 CO[C@H]1C[C@@H]1N MCULE-6295001950 [0,0,0,1,0,0|3,0,0]=4 1911 B6R1.8 CO[C@H]1C[C@@H]1N MCULE-7524472312 [0,0,0,1,0,0|3,0,0]=4 1912 B6R1.8 CO[C@H]1C[C@H]1N MCULE-3000810470 [0,0,0,1,0,0|3,0,0]=4 1913 B6R1.8 CO[C@H]1C[C@H]1N MCULE-6255571706 [0,0,0,1,0,0|3,0,0]=4 1914 B6R1.8 C[C@@H]1C[C@@H]1CN MCULE-5971817939 [0,0,0,1,0,0|2,0,0]=3 1915 B6R1.8 C[C@@H]1C[C@@H]1CO MCULE-7143685612 [0,0,0,1,0,0|1,0,0]=2 1916 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3418148363 [0,0,0,1,0,0|2,0,0]=3 1917 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3519756910 [0,0,0,1,0,0|2,0,0]=3 1918 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3649923384 [0,0,0,1,0,0|2,0,0]=3 1919 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-8330237030 [0,0,0,1,0,0|2,0,0]=3 1920 B6R1.8 C[C@@H]1C[C@H]1CO MCULE-3741611930 [0,0,0,1,0,0|1,0,0]=2 1921 B6R1.8 C[C@H]1C[C@@H]1CN MCULE-9856477951 [0,0,0,1,0,0|2,0,0]=3 1922 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-2846304871 [0,0,0,1,0,0|1,0,0]=2 1923 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-9275931471 [0,0,0,1,0,0|1,0,0]=2 1924 B6R1.8 C[C@H]1C[C@H]1CN MCULE-4949172422 [0,0,0,1,0,0|2,0,0]=3 1925 B6R1.8 C[C@H]1C[C@H]1CO MCULE-3828120088 [0,0,0,1,0,0|1,0,0]=2 1926 B6R1.8 C[C@H]1C[C@H]1CO MCULE-8442952820 [0,0,0,1,0,0|1,0,0]=2 1927 B6R1.8 NC1CC1CO MCULE-7666097515 [0,0,0,1,0,0|2,0,0]=3 1928 B6R1.8 NCC1CC1N MCULE-4864283129 [0,0,0,1,0,0|3,0,0]=4 1929 B6R1.8 NCC1CC1N MCULE-7029010792 [0,0,0,1,0,0|3,0,0]=4 1930 B6R1.8 OCC1CC1Cl MCULE-1321755136 [0,0,0,1,0,0|2,0,0]=3 1931 B6R1.8 OCC1C[C@@H]1F MCULE-2637570432 [0,0,0,1,0,0|2,0,0]=3 1932 B6R1.8 OC[C@@H]1C[C@@H]1F MCULE-9090620006 [0,0,0,1,0,0|2,0,0]=3 1933 B6R1.8 OC[C@@H]1C[C@H]1Br MCULE-8344332753 [0,0,0,1,0,0|2,0,0]=3 1934 B6R1.8 OC[C@@H]1C[C@H]1F MCULE-6282037947 [0,0,0,1,0,0|2,0,0]=3 1935 B6R1.8 OC[C@@H]1C[C@H]1F MCULE-8944803823 [0,0,0,1,0,0|2,0,0]=3 1936 B6R1.8 OC[C@H]1C[C@@H]1F MCULE-3157094299 [0,0,0,1,0,0|2,0,0]=3 1937 B3R0.1 BrCCBr MCULE-7586462642 [2,0,0,0,0,0|2,0,0]=4 1938 B3R0.1 BrCCI MCULE-8691237057 [2,0,0,0,0,0|2,0,0]=4 1939 B3R0.1 C#CCC MCULE-8090253856 [2,0,0,0,0,0|0,0,2]=4 1940 B3R0.1 C#CCO MCULE-3909200923 [2,0,0,0,0,0|0,0,2]=4 1941 B3R0.1 C/B=N/O MCULE-5227399299 [2,0,0,0,0,0|2,0,0]=4 1942 B3R0.1 C/C=N/O MCULE-2376410404 [2,0,0,0,0,0|1,0,1]=4 1943 B3R0.1 C=CCC MCULE-8167907130 [2,0,0,0,0,0|0,0,2]=4 1944 B3R0.1 C=CCO MCULE-2145308838 [2,0,0,0,0,0|0,0,2]=4 1945 B3R0.1 C=COC MCULE-4880746684 [2,0,0,0,0,0|0,0,2]=4 1946 B3R0.1 CC#CC MCULE-3721942346 [2,0,0,0,0,0|0,0,2]=4 1947 B3R0.1 CC=NO MCULE-9761317381 [2,0,0,0,0,0|1,0,1]=4 1948 B3R0.1 CCC#N MCULE-9484970536 [2,0,0,0,0,0|1,0,1]=4 1949 B3R0.1 CCC=O MCULE-4079744837 [2,0,0,0,0,0|0,0,2]=4 1950 B3R0.1 CCCBr MCULE-2393970713 [2,0,0,0,0,0|1,0,0]=3 1951 B3R0.1 CCCC MCULE-9760497805 [2,0,0,0,0,0|0,0,0]=2 1952 B3R0.1 CCCCl MCULE-3496412829 [2,0,0,0,0,0|1,0,0]=3 1953 B3R0.1 CCCF MCULE-8540338768 [2,0,0,0,0,0|1,0,0]=3 1954 B3R0.1 CCCI MCULE-1721488805 [2,0,0,0,0,0|1,0,0]=3 1955 B3R0.1 CCCN MCULE-2885523792 [2,0,0,0,0,0|1,0,0]=3 1956 B3R0.1 CCCN MCULE-4318907091 [2,0,0,0,0,0|1,0,0]=3 1957 B3R0.1 CCCN MCULE-6330457870 [2,0,0,0,0,0|1,0,0]=3 1958 B3R0.1 CCCN MCULE-7146820007 [2,0,0,0,0,0|1,0,0]=3 1959 B3R0.1 CCCO MCULE-6252105126 [2,0,0,0,0,0|0,0,0]=2 1960 B3R0.1 CCCS MCULE-8267649092 [2,0,0,0,0,0|0,1,0]=3 1961 B3R0.1 CCNC MCULE-7215376398 [2,0,0,0,0,0|1,0,0]=3 1962 B3R0.1 CCNC MCULE-9811899205 [2,0,0,0,0,0|1,0,0]=3 1963 B3R0.1 CCNN MCULE-4753127904 [2,0,0,0,0,0|2,0,0]=4 1964 B3R0.1 CCNN MCULE-7630363192 [2,0,0,0,0,0|2,0,0]=4 1965 B3R0.1 CCNN MCULE-8402230944 [2,0,0,0,0,0|2,0,0]=4 1966 B3R0.1 CCNO MCULE-1215586669 [2,0,0,0,0,0|1,0,0]=3 1967 B3R0.1 CCNO MCULE-7075818857 [2,0,0,0,0,0|1,0,0]=3 1968 B3R0.1 CCON MCULE-5316082054 [2,0,0,0,0,0|1,0,0]=3 1969 B3R0.1 CCON MCULE-6621418839 [2,0,0,0,0,0|1,0,0]=3 1970 B3R0.1 CCO[NH3+] MCULE-7670481464 [2,0,0,0,0,0|1,0,0]=3 1971 B3R0.1 CCO[NH3+] MCULE-7871083232 [2,0,0,0,0,0|1,0,0]=3 1972 B3R0.1 CCSC MCULE-6944750263 [2,0,0,0,0,0|0,1,0]=3 1973 B3R0.1 CNNC MCULE-5932476941 [2,0,0,0,0,0|2,0,0]=4 1974 B3R0.1 CNNC MCULE-6419598860 [2,0,0,0,0,0|2,0,0]=4 1975 B3R0.1 CNOC MCULE-1706082503 [2,0,0,0,0,0|1,0,0]=3 1976 B3R0.1 CNOC MCULE-6224540090 [2,0,0,0,0,0|1,0,0]=3 1977 B3R0.1 COC=O MCULE-9122749354 [2,0,0,0,0,0|0,0,2]=4 1978 B3R0.1 COCBr MCULE-2566721472 [2,0,0,0,0,0|1,0,0]=3 1979 B3R0.1 COCCl MCULE-5928768006 [2,0,0,0,0,0|1,0,0]=3 1980 B3R0.1 COCI MCULE-5215132549 [2,0,0,0,0,0|1,0,0]=3 1981 B3R0.1 CSCCl MCULE-1281800596 [2,0,0,0,0,0|1,1,0]=4 1982 B3R0.1 CSSC MCULE-7451882535 [2,0,0,0,0,0|1,1,0]=4 1983 B3R0.1 C[Se][Se]C MCULE-1189700302 [2,0,0,0,0,0|1,1,0]=4 1984 B3R0.1 ClCCBr MCULE-3933774075 [2,0,0,0,0,0|2,0,0]=4 1985 B3R0.1 ClCCCl MCULE-3493741440 [2,0,0,0,0,0|2,0,0]=4 1986 B3R0.1 ClCCI MCULE-7847880962 [2,0,0,0,0,0|2,0,0]=4 1987 B3R0.1 FCCBr MCULE-3117974140 [2,0,0,0,0,0|2,0,0]=4 1988 B3R0.1 FCCCl MCULE-1862981403 [2,0,0,0,0,0|2,0,0]=4 1989 B3R0.1 FCCF MCULE-1975194621 [2,0,0,0,0,0|2,0,0]=4 1990 B3R0.1 FCCI MCULE-3689313503 [2,0,0,0,0,0|2,0,0]=4 1991 B3R0.1 ICCI MCULE-8025471988 [2,0,0,0,0,0|2,0,0]=4 1992 B3R0.1 NCCBr MCULE-3401124597 [2,0,0,0,0,0|2,0,0]=4 1993 B3R0.1 NCCBr MCULE-6215378497 [2,0,0,0,0,0|2,0,0]=4 1994 B3R0.1 NCCCl MCULE-1458699843 [2,0,0,0,0,0|2,0,0]=4 1995 B3R0.1 NCCCl MCULE-6944306112 [2,0,0,0,0,0|2,0,0]=4 1996 B3R0.1 NCCF MCULE-1670520169 [2,0,0,0,0,0|2,0,0]=4 1997 B3R0.1 NCCF MCULE-4963351029 [2,0,0,0,0,0|2,0,0]=4 1998 B3R0.1 NCCI MCULE-6905308399 [2,0,0,0,0,0|2,0,0]=4 1999 B3R0.1 NCCI MCULE-7487764362 [2,0,0,0,0,0|2,0,0]=4 2000 B3R0.1 NCCN MCULE-4740333723 [2,0,0,0,0,0|2,0,0]=4 2001 B3R0.1 NCCN MCULE-6795272853 [2,0,0,0,0,0|2,0,0]=4 2002 B3R0.1 NCCN MCULE-8304126024 [2,0,0,0,0,0|2,0,0]=4 2003 B3R0.1 NCCN MCULE-8325612144 [2,0,0,0,0,0|2,0,0]=4 2004 B3R0.1 NCCO MCULE-5175116598 [2,0,0,0,0,0|1,0,0]=3 2005 B3R0.1 NCCO MCULE-8624730373 [2,0,0,0,0,0|1,0,0]=3 2006 B3R0.1 NCCS MCULE-1838427828 [2,0,0,0,0,0|1,1,0]=4 2007 B3R0.1 NCCS MCULE-2418938683 [2,0,0,0,0,0|1,1,0]=4 2008 B3R0.1 OCCBr MCULE-5097256006 [2,0,0,0,0,0|1,0,0]=3 2009 B3R0.1 OCCCl MCULE-5139580173 [2,0,0,0,0,0|1,0,0]=3 2010 B3R0.1 OCCF MCULE-7590677201 [2,0,0,0,0,0|1,0,0]=3 2011 B3R0.1 OCCI MCULE-8359750387 [2,0,0,0,0,0|1,0,0]=3 2012 B3R0.1 OCCO MCULE-6366313128 [2,0,0,0,0,0|0,0,0]=2 2013 B3R0.1 OCCS MCULE-2252943288 [2,0,0,0,0,0|0,1,0]=3 2014 B3R0.1 PCCP MCULE-2159678577 [2,0,0,0,0,0|2,0,0]=4 2015 B3R0.1 SCCBr MCULE-5899941299 [2,0,0,0,0,0|1,1,0]=4 2016 B3R0.1 SCCS MCULE-8277435664 [2,0,0,0,0,0|0,2,0]=4 2017 B3R0.1 [NH3+]CCS MCULE-6407472407 [2,0,0,0,0,0|1,1,0]=4 2018 B3R0.1 [NH3+]CC[NH3+] MCULE-5313549416 [2,0,0,0,0,0|2,0,0]=4 2019 B5R0.1 C#CCC(C)C MCULE-2506063278 [1,1,0,0,0,0|1,0,1]=4 2020 B5R0.1 C#CCC(C)N MCULE-1523044787 [1,1,0,0,0,0|1,0,1]=4 2021 B5R0.1 C#CCC(C)N MCULE-3399522488 [1,1,0,0,0,0|1,0,1]=4 2022 B5R0.1 C#CCC(C)O MCULE-2487589857 [1,1,0,0,0,0|0,0,2]=4 2023 B5R0.1 C(C)(N)CCC MCULE-4800297905 [1,1,0,0,0,0|1,0,0]=3 2024 B5R0.1 C(C)(N)CCC MCULE-7674864567 [1,1,0,0,0,0|1,0,0]=3 2025 B5R0.1 C(C)(N)CCO MCULE-5545469271 [1,1,0,0,0,0|0,0,0]=2 2026 B5R0.1 C/C=C/C(C)C MCULE-8705863155 [1,1,0,0,0,0|1,0,1]=4 2027 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [1,1,0,0,0,0|0,0,2]=4 2028 B5R0.1 C=C(Br)CCO MCULE-3743908958 [1,1,0,0,0,0|0,0,2]=4 2029 B5R0.1 C=C(Br)COC MCULE-5349428431 [1,1,0,0,0,0|1,0,1]=4 2030 B5R0.1 C=C(C)CCBr MCULE-3439794005 [1,1,0,0,0,0|1,0,1]=4 2031 B5R0.1 C=C(C)CCC MCULE-8225129744 [1,1,0,0,0,0|1,0,1]=4 2032 B5R0.1 C=C(C)CCCl MCULE-2816016781 [1,1,0,0,0,0|1,0,1]=4 2033 B5R0.1 C=C(C)CCI MCULE-6317205481 [1,1,0,0,0,0|1,0,1]=4 2034 B5R0.1 C=C(C)CCN MCULE-4037025602 [1,1,0,0,0,0|1,0,1]=4 2035 B5R0.1 C=C(C)CCN MCULE-5001503744 [1,1,0,0,0,0|1,0,1]=4 2036 B5R0.1 C=C(C)CCO MCULE-2689800711 [1,1,0,0,0,0|0,0,1]=3 2037 B5R0.1 C=C(C)OCC MCULE-5303468686 [1,1,0,0,0,0|0,0,1]=3 2038 B5R0.1 C=CCC(C)Br MCULE-5638987302 [1,1,0,0,0,0|1,0,1]=4 2039 B5R0.1 C=CCC(C)C MCULE-4586731422 [1,1,0,0,0,0|1,0,1]=4 2040 B5R0.1 C=CCC(C)N MCULE-5354228552 [1,1,0,0,0,0|1,0,1]=4 2041 B5R0.1 C=CCC(C)N MCULE-9454660067 [1,1,0,0,0,0|1,0,1]=4 2042 B5R0.1 C=CCC(C)O MCULE-7724200334 [1,1,0,0,0,0|0,0,2]=4 2043 B5R0.1 C=CCC(C)O MCULE-9910771503 [1,1,0,0,0,0|0,0,2]=4 2044 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [1,1,0,0,0,0|0,0,2]=4 2045 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [1,1,0,0,0,0|0,0,2]=4 2046 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [1,1,0,0,0,0|1,0,1]=4 2047 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [1,1,0,0,0,0|1,0,1]=4 2048 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [1,1,0,0,0,0|0,0,2]=4 2049 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [1,1,0,0,0,0|0,0,2]=4 2050 B5R0.1 C=COC(C)C MCULE-6339383821 [1,1,0,0,0,0|0,0,2]=4 2051 B5R0.1 CC#CC(C)C MCULE-9841369985 [1,1,0,0,0,0|1,0,1]=4 2052 B5R0.1 CC#CC(C)O MCULE-5523814936 [1,1,0,0,0,0|0,0,2]=4 2053 B5R0.1 CC(=CCO)C MCULE-3984123588 [1,1,0,0,0,0|0,0,2]=4 2054 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [1,1,0,0,0,0|0,0,2]=4 2055 B5R0.1 CC(=CCO)I MCULE-4600854759 [1,1,0,0,0,0|0,0,2]=4 2056 B5R0.1 CC(=O)CCBr MCULE-2615300206 [1,1,0,0,0,0|1,0,1]=4 2057 B5R0.1 CC(=O)CCCl MCULE-8019748964 [1,1,0,0,0,0|1,0,1]=4 2058 B5R0.1 CC(=O)CCN MCULE-7550348751 [1,1,0,0,0,0|1,0,1]=4 2059 B5R0.1 CC(=O)CCN MCULE-9519063810 [1,1,0,0,0,0|1,0,1]=4 2060 B5R0.1 CC(=O)CCO MCULE-6328537335 [1,1,0,0,0,0|0,0,1]=3 2061 B5R0.1 CC(=O)NCO MCULE-4563335540 [1,1,0,0,0,0|1,0,1]=4 2062 B5R0.1 CC(=O)OCBr MCULE-9842804945 [1,1,0,0,0,0|1,0,1]=4 2063 B5R0.1 CC(=O)OCCl MCULE-6822222026 [1,1,0,0,0,0|1,0,1]=4 2064 B5R0.1 CC(Br)CC#N MCULE-6321379216 [1,1,0,0,0,0|1,0,1]=4 2065 B5R0.1 CC(Br)CCBr MCULE-1045475402 [1,1,0,0,0,0|1,0,0]=3 2066 B5R0.1 CC(C)/C=N/O MCULE-3201457095 [1,1,0,0,0,0|1,0,1]=4 2067 B5R0.1 CC(C)C=NO MCULE-9842574696 [1,1,0,0,0,0|1,0,1]=4 2068 B5R0.1 CC(C)CC#N MCULE-4346986727 [1,1,0,0,0,0|1,0,1]=4 2069 B5R0.1 CC(C)CC=O MCULE-2939497534 [1,1,0,0,0,0|0,0,2]=4 2070 B5R0.1 CC(C)CCBr MCULE-7163010428 [1,1,0,0,0,0|1,0,0]=3 2071 B5R0.1 CC(C)CCCl MCULE-8360122696 [1,1,0,0,0,0|1,0,0]=3 2072 B5R0.1 CC(C)CCCl MCULE-9017922949 [1,1,0,0,0,0|1,0,0]=3 2073 B5R0.1 CC(C)CCI MCULE-4934529500 [1,1,0,0,0,0|1,0,0]=3 2074 B5R0.1 CC(C)CCN MCULE-3081003576 [1,1,0,0,0,0|1,0,0]=3 2075 B5R0.1 CC(C)CCN MCULE-5118782389 [1,1,0,0,0,0|1,0,0]=3 2076 B5R0.1 CC(C)CCN MCULE-5217981670 [1,1,0,0,0,0|1,0,0]=3 2077 B5R0.1 CC(C)CCN MCULE-6280940933 [1,1,0,0,0,0|1,0,0]=3 2078 B5R0.1 CC(C)CCO MCULE-7411270401 [1,1,0,0,0,0|0,0,0]=2 2079 B5R0.1 CC(C)CCS MCULE-7115473363 [1,1,0,0,0,0|0,1,0]=3 2080 B5R0.1 CC(C)CNN MCULE-6797887001 [1,1,0,0,0,0|2,0,0]=4 2081 B5R0.1 CC(C)CNN MCULE-9592971233 [1,1,0,0,0,0|2,0,0]=4 2082 B5R0.1 CC(C)CNN MCULE-9725792452 [1,1,0,0,0,0|2,0,0]=4 2083 B5R0.1 CC(C)CON MCULE-3476786246 [1,1,0,0,0,0|2,0,0]=4 2084 B5R0.1 CC(C)CON MCULE-4450654727 [1,1,0,0,0,0|2,0,0]=4 2085 B5R0.1 CC(C)OC=O MCULE-8263698122 [1,1,0,0,0,0|0,0,2]=4 2086 B5R0.1 CC(C)OCCl MCULE-3680602217 [1,1,0,0,0,0|1,0,0]=3 2087 B5R0.1 CC(C)SCCl MCULE-3836735379 [1,1,0,0,0,0|1,1,0]=4 2088 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [1,1,0,0,0,0|1,0,0]=3 2089 B5R0.1 CC(Cl)CCO MCULE-1955496242 [1,1,0,0,0,0|0,0,0]=2 2090 B5R0.1 CC(F)CCBr MCULE-3035340901 [1,1,0,0,0,0|1,0,0]=3 2091 B5R0.1 CC(F)CCI MCULE-6469250150 [1,1,0,0,0,0|1,0,0]=3 2092 B5R0.1 CC(F)CCN MCULE-2805813131 [1,1,0,0,0,0|1,0,0]=3 2093 B5R0.1 CC(F)CCN MCULE-5849913362 [1,1,0,0,0,0|1,0,0]=3 2094 B5R0.1 CC(N)CC#N MCULE-2350352782 [1,1,0,0,0,0|1,0,1]=4 2095 B5R0.1 CC(N)CC#N MCULE-7269201059 [1,1,0,0,0,0|1,0,1]=4 2096 B5R0.1 CC(N)CCN MCULE-5308134596 [1,1,0,0,0,0|1,0,0]=3 2097 B5R0.1 CC(N)CCN MCULE-5880045507 [1,1,0,0,0,0|1,0,0]=3 2098 B5R0.1 CC(N)CCN MCULE-7827515430 [1,1,0,0,0,0|1,0,0]=3 2099 B5R0.1 CC(N)CCO MCULE-1771399942 [1,1,0,0,0,0|0,0,0]=2 2100 B5R0.1 CC(N)CCO MCULE-7239872808 [1,1,0,0,0,0|0,0,0]=2 2101 B5R0.1 CC(O)CC#N MCULE-7172428142 [1,1,0,0,0,0|1,0,1]=4 2102 B5R0.1 CC(O)CCBr MCULE-7983169885 [1,1,0,0,0,0|1,0,0]=3 2103 B5R0.1 CC(O)CCCl MCULE-2952545606 [1,1,0,0,0,0|1,0,0]=3 2104 B5R0.1 CC(O)CCN MCULE-6836791276 [1,1,0,0,0,0|1,0,0]=3 2105 B5R0.1 CC(O)CCN MCULE-7186260925 [1,1,0,0,0,0|1,0,0]=3 2106 B5R0.1 CC(O)CCO MCULE-1694239851 [1,1,0,0,0,0|0,0,0]=2 2107 B5R0.1 CC(O)CCO MCULE-7784884948 [1,1,0,0,0,0|0,0,0]=2 2108 B5R0.1 CC(O)CNN MCULE-4956670781 [1,1,0,0,0,0|2,0,0]=4 2109 B5R0.1 CC(O)CNN MCULE-7917439573 [1,1,0,0,0,0|2,0,0]=4 2110 B5R0.1 CC(O)CON MCULE-1051091134 [1,1,0,0,0,0|1,0,0]=3 2111 B5R0.1 CC(O)CON MCULE-6722092589 [1,1,0,0,0,0|1,0,0]=3 2112 B5R0.1 CC(S)CCO MCULE-5702212503 [1,1,0,0,0,0|0,0,0]=2 2113 B5R0.1 CC=CC(C)C MCULE-9898453837 [1,1,0,0,0,0|1,0,1]=4 2114 B5R0.1 CC=CC(C)O MCULE-4806592836 [1,1,0,0,0,0|0,0,2]=4 2115 B5R0.1 CCC=C(C)C MCULE-2405063894 [1,1,0,0,0,0|1,0,1]=4 2116 B5R0.1 CCCB(O)O MCULE-4994980798 [1,1,0,0,0,0|1,0,0]=3 2117 B5R0.1 CCCC(=N)N MCULE-5974105638 [1,1,0,0,0,0|1,0,1]=4 2118 B5R0.1 CCCC(=N)N MCULE-9230704591 [1,1,0,0,0,0|1,0,1]=4 2119 B5R0.1 CCCC(=O)C MCULE-7174095676 [1,1,0,0,0,0|0,0,2]=4 2120 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [1,1,0,0,0,0|0,0,2]=4 2121 B5R0.1 CCCC(=O)N MCULE-2712067671 [1,1,0,0,0,0|0,0,2]=4 2122 B5R0.1 CCCC(=O)O MCULE-4116382006 [1,1,0,0,0,0|0,0,1]=3 2123 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [1,1,0,0,0,0|0,0,2]=4 2124 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [1,1,0,0,0,0|0,0,2]=4 2125 B5R0.1 CCCC(=S)N MCULE-3529335988 [1,1,0,0,0,0|0,1,1]=4 2126 B5R0.1 CCCC(=S)O MCULE-3382199964 [1,1,0,0,0,0|0,0,1]=3 2127 B5R0.1 CCCC(C)Br MCULE-3178073667 [1,1,0,0,0,0|1,0,0]=3 2128 B5R0.1 CCCC(C)C MCULE-9604552974 [1,1,0,0,0,0|1,0,0]=3 2129 B5R0.1 CCCC(C)N MCULE-2640298430 [1,1,0,0,0,0|1,0,0]=3 2130 B5R0.1 CCCC(C)N MCULE-7225905167 [1,1,0,0,0,0|1,0,0]=3 2131 B5R0.1 CCCC(C)O MCULE-8205906299 [1,1,0,0,0,0|0,0,0]=2 2132 B5R0.1 CCCC(C)S MCULE-1649095713 [1,1,0,0,0,0|0,1,0]=3 2133 B5R0.1 CCCC(O)Cl MCULE-3188577082 [1,1,0,0,0,0|0,0,0]=2 2134 B5R0.1 CCCN(=O)=O MCULE-5615753372 [1,1,0,0,0,0|1,0,1]=4 2135 B5R0.1 CCCN(C)C MCULE-8702643596 [1,1,0,0,0,0|2,0,0]=4 2136 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [1,1,0,0,0,0|1,0,1]=4 2137 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [1,1,0,0,0,0|1,0,1]=4 2138 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [1,1,0,0,0,0|1,0,0]=3 2139 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [1,1,0,0,0,0|1,0,0]=3 2140 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [1,1,0,0,0,0|1,0,0]=3 2141 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [1,1,0,0,0,0|1,0,0]=3 2142 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [1,1,0,0,0,0|0,0,0]=2 2143 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [1,1,0,0,0,0|1,0,0]=3 2144 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [1,1,0,0,0,0|1,0,0]=3 2145 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [1,1,0,0,0,0|1,0,0]=3 2146 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [1,1,0,0,0,0|1,0,0]=3 2147 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [1,1,0,0,0,0|0,0,0]=2 2148 B5R0.1 CCNC(=O)C MCULE-7543656350 [1,1,0,0,0,0|1,0,1]=4 2149 B5R0.1 CCNC(C)C MCULE-8064118469 [1,1,0,0,0,0|1,0,0]=3 2150 B5R0.1 CCOC(=N)C MCULE-3060267072 [1,1,0,0,0,0|0,0,1]=3 2151 B5R0.1 CCOC(=N)C MCULE-3943786182 [1,1,0,0,0,0|0,0,1]=3 2152 B5R0.1 CCOC(=N)N MCULE-3570858508 [1,1,0,0,0,0|1,0,1]=4 2153 B5R0.1 CCOC(=N)N MCULE-6061063856 [1,1,0,0,0,0|1,0,1]=4 2154 B5R0.1 CCOC(=O)C MCULE-6628539781 [1,1,0,0,0,0|0,0,1]=3 2155 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [1,1,0,0,0,0|0,0,2]=4 2156 B5R0.1 CCOC(=O)N MCULE-1776877276 [1,1,0,0,0,0|0,0,2]=4 2157 B5R0.1 CCOC(=S)C MCULE-3358897597 [1,1,0,0,0,0|0,0,1]=3 2158 B5R0.1 CCOC(=S)N MCULE-4649285010 [1,1,0,0,0,0|0,1,1]=4 2159 B5R0.1 CCOC(=S)[S-] MCULE-6247969567 [1,1,0,0,0,0|0,1,1]=4 2160 B5R0.1 CCOC(=S)[S-] MCULE-6902289618 [1,1,0,0,0,0|0,1,1]=4 2161 B5R0.1 CCOC(=S)[S-] MCULE-9105300958 [1,1,0,0,0,0|0,1,1]=4 2162 B5R0.1 CCOC(C)C MCULE-1934548340 [1,1,0,0,0,0|0,0,0]=2 2163 B5R0.1 CCOC(C)Cl MCULE-8486994638 [1,1,0,0,0,0|0,0,0]=2 2164 B5R0.1 CCOP(Cl)Cl MCULE-1218379857 [1,1,0,0,0,0|2,0,0]=4 2165 B5R0.1 CCSC(=O)C MCULE-8015440229 [1,1,0,0,0,0|0,1,1]=4 2166 B5R0.1 CCSC(=S)C MCULE-1502137460 [1,1,0,0,0,0|0,1,1]=4 2167 B5R0.1 CCSC(C)C MCULE-3738251898 [1,1,0,0,0,0|0,1,0]=3 2168 B5R0.1 CN(C)CCBr MCULE-4844398053 [1,1,0,0,0,0|2,0,0]=4 2169 B5R0.1 CN(C)CCCl MCULE-4297554717 [1,1,0,0,0,0|2,0,0]=4 2170 B5R0.1 CN(C)CCCl MCULE-4465544992 [1,1,0,0,0,0|2,0,0]=4 2171 B5R0.1 CN(C)CCI MCULE-4687894526 [1,1,0,0,0,0|2,0,0]=4 2172 B5R0.1 CN(C)CCI MCULE-7464680246 [1,1,0,0,0,0|2,0,0]=4 2173 B5R0.1 CN(C)CCI MCULE-9051868668 [1,1,0,0,0,0|2,0,0]=4 2174 B5R0.1 CN(C)CCN MCULE-6693759372 [1,1,0,0,0,0|2,0,0]=4 2175 B5R0.1 CN(C)CCN MCULE-6929925748 [1,1,0,0,0,0|2,0,0]=4 2176 B5R0.1 CN(C)CCN MCULE-7881547574 [1,1,0,0,0,0|2,0,0]=4 2177 B5R0.1 CN(C)CCO MCULE-5715813465 [1,1,0,0,0,0|1,0,0]=3 2178 B5R0.1 CN(C)CCO MCULE-7567469160 [1,1,0,0,0,0|1,0,0]=3 2179 B5R0.1 CN(C)CCO MCULE-9024108074 [1,1,0,0,0,0|1,0,0]=3 2180 B5R0.1 CN(C)CCS MCULE-4356815596 [1,1,0,0,0,0|1,1,0]=4 2181 B5R0.1 CN(C)CCS MCULE-4611688723 [1,1,0,0,0,0|1,1,0]=4 2182 B5R0.1 CN(C)CCS MCULE-6259585517 [1,1,0,0,0,0|1,1,0]=4 2183 B5R0.1 CN(N)CCN MCULE-2782966878 [1,1,0,0,0,0|2,0,0]=4 2184 B5R0.1 CNCC(=O)O MCULE-3448356048 [1,1,0,0,0,0|1,0,1]=4 2185 B5R0.1 CNCC(=O)O MCULE-4484444573 [1,1,0,0,0,0|1,0,1]=4 2186 B5R0.1 CNCC(C)C MCULE-6582386339 [1,1,0,0,0,0|2,0,0]=4 2187 B5R0.1 CNCC(C)C MCULE-6856717783 [1,1,0,0,0,0|2,0,0]=4 2188 B5R0.1 CNCC(C)F MCULE-4381138647 [1,1,0,0,0,0|2,0,0]=4 2189 B5R0.1 CNCC(C)F MCULE-9018181183 [1,1,0,0,0,0|2,0,0]=4 2190 B5R0.1 CNCC(C)O MCULE-3671071529 [1,1,0,0,0,0|1,0,0]=3 2191 B5R0.1 CNCC(C)O MCULE-4171705304 [1,1,0,0,0,0|1,0,0]=3 2192 B5R0.1 CNCC(Cl)Cl MCULE-1176483469 [1,1,0,0,0,0|2,0,0]=4 2193 B5R0.1 CNCC(Cl)Cl MCULE-8474434261 [1,1,0,0,0,0|2,0,0]=4 2194 B5R0.1 CNCC(F)F MCULE-3004221847 [1,1,0,0,0,0|2,0,0]=4 2195 B5R0.1 CNCC(F)F MCULE-5997956111 [1,1,0,0,0,0|2,0,0]=4 2196 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [1,1,0,0,0,0|1,0,0]=3 2197 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [1,1,0,0,0,0|1,0,0]=3 2198 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [1,1,0,0,0,0|1,0,0]=3 2199 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [1,1,0,0,0,0|1,0,0]=3 2200 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [1,1,0,0,0,0|1,0,0]=3 2201 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [1,1,0,0,0,0|1,0,0]=3 2202 B5R0.1 CNOC(=O)C MCULE-1464426541 [1,1,0,0,0,0|1,0,1]=4 2203 B5R0.1 CNOC(=O)C MCULE-2976282666 [1,1,0,0,0,0|1,0,1]=4 2204 B5R0.1 COCC(=N)N MCULE-4711728356 [1,1,0,0,0,0|1,0,1]=4 2205 B5R0.1 COCC(=N)N MCULE-7163250467 [1,1,0,0,0,0|1,0,1]=4 2206 B5R0.1 COCC(=O)C MCULE-7262197587 [1,1,0,0,0,0|0,0,2]=4 2207 B5R0.1 COCC(=O)Cl MCULE-5449267495 [1,1,0,0,0,0|0,0,2]=4 2208 B5R0.1 COCC(=O)N MCULE-6674958132 [1,1,0,0,0,0|0,0,2]=4 2209 B5R0.1 COCC(=O)O MCULE-3945589151 [1,1,0,0,0,0|0,0,1]=3 2210 B5R0.1 COCC(=S)N MCULE-2046809269 [1,1,0,0,0,0|0,1,1]=4 2211 B5R0.1 COCC(C)Br MCULE-6850689931 [1,1,0,0,0,0|1,0,0]=3 2212 B5R0.1 COCC(C)I MCULE-8608265714 [1,1,0,0,0,0|1,0,0]=3 2213 B5R0.1 COCC(C)N MCULE-1896873634 [1,1,0,0,0,0|1,0,0]=3 2214 B5R0.1 COCC(C)N MCULE-2549420211 [1,1,0,0,0,0|1,0,0]=3 2215 B5R0.1 COCC(C)N MCULE-3490410444 [1,1,0,0,0,0|1,0,0]=3 2216 B5R0.1 COCC(C)N MCULE-7089888882 [1,1,0,0,0,0|1,0,0]=3 2217 B5R0.1 COCC(C)O MCULE-4022733014 [1,1,0,0,0,0|0,0,0]=2 2218 B5R0.1 COCC(C)O MCULE-7513310960 [1,1,0,0,0,0|0,0,0]=2 2219 B5R0.1 COCN(C)C MCULE-1963225930 [1,1,0,0,0,0|2,0,0]=4 2220 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [1,1,0,0,0,0|1,0,0]=3 2221 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [1,1,0,0,0,0|1,0,0]=3 2222 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [1,1,0,0,0,0|1,0,0]=3 2223 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [1,1,0,0,0,0|1,0,0]=3 2224 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [1,1,0,0,0,0|0,0,0]=2 2225 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [1,1,0,0,0,0|0,0,0]=2 2226 B5R0.1 COC[C@H](C)N MCULE-2465679418 [1,1,0,0,0,0|1,0,0]=3 2227 B5R0.1 COC[C@H](C)N MCULE-2998593539 [1,1,0,0,0,0|1,0,0]=3 2228 B5R0.1 COC[C@H](C)N MCULE-3161045661 [1,1,0,0,0,0|1,0,0]=3 2229 B5R0.1 COC[C@H](C)N MCULE-9550165578 [1,1,0,0,0,0|1,0,0]=3 2230 B5R0.1 COC[C@H](C)O MCULE-5908531683 [1,1,0,0,0,0|0,0,0]=2 2231 B5R0.1 COC[C@H](C)O MCULE-8619138238 [1,1,0,0,0,0|0,0,0]=2 2232 B5R0.1 CS(=O)CCBr MCULE-7846126230 [1,1,0,0,0,0|1,1,0]=4 2233 B5R0.1 CS(=O)CCCl MCULE-7012781505 [1,1,0,0,0,0|1,1,0]=4 2234 B5R0.1 CS(=O)CCN MCULE-6497874560 [1,1,0,0,0,0|1,1,0]=4 2235 B5R0.1 CS(=O)CCN MCULE-8275663766 [1,1,0,0,0,0|1,1,0]=4 2236 B5R0.1 CS(=O)CCN MCULE-8330490290 [1,1,0,0,0,0|1,1,0]=4 2237 B5R0.1 CS(=O)CCO MCULE-8331553582 [1,1,0,0,0,0|0,1,0]=3 2238 B5R0.1 CSCC(=O)O MCULE-7003418159 [1,1,0,0,0,0|0,1,1]=4 2239 B5R0.1 CSCC(C)N MCULE-7985946030 [1,1,0,0,0,0|1,1,0]=4 2240 B5R0.1 CSCC(C)O MCULE-2227652351 [1,1,0,0,0,0|0,1,0]=3 2241 B5R0.1 C[C@@H](N)CC#N MCULE-1923686728 [1,1,0,0,0,0|1,0,1]=4 2242 B5R0.1 C[C@@H](N)CC#N MCULE-5694530830 [1,1,0,0,0,0|1,0,1]=4 2243 B5R0.1 C[C@@H](N)CC#N MCULE-8880445785 [1,1,0,0,0,0|1,0,1]=4 2244 B5R0.1 C[C@@H](N)CC#N MCULE-9410509782 [1,1,0,0,0,0|1,0,1]=4 2245 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [1,1,0,0,0,0|0,0,0]=2 2246 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [1,1,0,0,0,0|0,0,0]=2 2247 B5R0.1 C[C@@H](O)CC#N MCULE-2879004464 [1,1,0,0,0,0|1,0,1]=4 2248 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [1,1,0,0,0,0|1,0,0]=3 2249 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [1,1,0,0,0,0|1,0,0]=3 2250 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [1,1,0,0,0,0|1,0,0]=3 2251 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [1,1,0,0,0,0|1,0,0]=3 2252 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [1,1,0,0,0,0|0,0,0]=2 2253 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [1,1,0,0,0,0|0,0,0]=2 2254 B5R0.1 C[C@@H](O)CON MCULE-3740397343 [1,1,0,0,0,0|1,0,0]=3 2255 B5R0.1 C[C@@H](O)CON MCULE-8274376872 [1,1,0,0,0,0|1,0,0]=3 2256 B5R0.1 C[C@H](N)CC#N MCULE-1876010727 [1,1,0,0,0,0|1,0,1]=4 2257 B5R0.1 C[C@H](N)CC#N MCULE-6927344020 [1,1,0,0,0,0|1,0,1]=4 2258 B5R0.1 C[C@H](N)CC#N MCULE-9082410813 [1,1,0,0,0,0|1,0,1]=4 2259 B5R0.1 C[C@H](N)CC#N MCULE-9498047771 [1,1,0,0,0,0|1,0,1]=4 2260 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [1,1,0,0,0,0|0,0,0]=2 2261 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [1,1,0,0,0,0|0,0,0]=2 2262 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [1,1,0,0,0,0|0,0,0]=2 2263 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [1,1,0,0,0,0|0,0,0]=2 2264 B5R0.1 C[C@H](O)CC#N MCULE-1968982761 [1,1,0,0,0,0|1,0,1]=4 2265 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [1,1,0,0,0,0|1,0,0]=3 2266 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [1,1,0,0,0,0|1,0,0]=3 2267 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [1,1,0,0,0,0|0,0,0]=2 2268 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [1,1,0,0,0,0|0,0,0]=2 2269 B5R0.1 C[C@H](O)CON MCULE-4216605221 [1,1,0,0,0,0|1,0,0]=3 2270 B5R0.1 C[C@H](O)CON MCULE-9863094719 [1,1,0,0,0,0|1,0,0]=3 2271 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [1,1,0,0,0,0|2,0,0]=4 2272 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [1,1,0,0,0,0|1,1,0]=4 2273 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [1,1,0,0,0,0|1,1,0]=4 2274 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [1,1,0,0,0,0|0,1,0]=3 2275 B5R0.1 N=C(N)CCO MCULE-4567824707 [1,1,0,0,0,0|1,0,1]=4 2276 B5R0.1 N=C(N)CCO MCULE-7139693715 [1,1,0,0,0,0|1,0,1]=4 2277 B5R0.1 NC(=O)CCO MCULE-4026170350 [1,1,0,0,0,0|1,0,1]=4 2278 B5R0.1 NCCC(=O)O MCULE-1344289084 [1,1,0,0,0,0|1,0,1]=4 2279 B5R0.1 NCCC(=O)O MCULE-2298605337 [1,1,0,0,0,0|1,0,1]=4 2280 B5R0.1 NCCC(=O)O MCULE-9375577631 [1,1,0,0,0,0|1,0,1]=4 2281 B5R0.1 NCCC(F)F MCULE-3610134573 [1,1,0,0,0,0|2,0,0]=4 2282 B5R0.1 NCCC(F)F MCULE-5561095460 [1,1,0,0,0,0|2,0,0]=4 2283 B5R0.1 NCCP(=O)O MCULE-7093964616 [1,1,0,0,0,0|2,0,0]=4 2284 B5R0.1 NCCS(=O)O MCULE-4372248641 [1,1,0,0,0,0|2,0,0]=4 2285 B5R0.1 NOCC(=O)O MCULE-4566186819 [1,1,0,0,0,0|1,0,1]=4 2286 B5R0.1 NOCC(=O)O MCULE-4824237418 [1,1,0,0,0,0|1,0,1]=4 2287 B5R0.1 NOCC(=O)O MCULE-8132180423 [1,1,0,0,0,0|1,0,1]=4 2288 B5R0.1 NOCC(F)F MCULE-1860693804 [1,1,0,0,0,0|2,0,0]=4 2289 B5R0.1 NOCC(F)F MCULE-2698080780 [1,1,0,0,0,0|2,0,0]=4 2290 B5R0.1 O=C(O)CCBr MCULE-2816055853 [1,1,0,0,0,0|1,0,1]=4 2291 B5R0.1 O=C(O)CCCl MCULE-8511144183 [1,1,0,0,0,0|1,0,1]=4 2292 B5R0.1 O=C(O)CCF MCULE-4382025684 [1,1,0,0,0,0|1,0,1]=4 2293 B5R0.1 O=C(O)CCI MCULE-3371354708 [1,1,0,0,0,0|1,0,1]=4 2294 B5R0.1 O=C(O)CCO MCULE-3428604829 [1,1,0,0,0,0|1,0,1]=4 2295 B5R0.1 O=C(O)CCS MCULE-3211932163 [1,1,0,0,0,0|1,0,1]=4 2296 B5R0.1 O=C([O-])CCO MCULE-4429611588 [1,1,0,0,0,0|1,0,1]=4 2297 B5R0.1 O=N(=O)CCO MCULE-2060841405 [1,1,0,0,0,0|2,0,0]=4 2298 B5R0.1 OCCC(F)F MCULE-9207688926 [1,1,0,0,0,0|1,0,0]=3 2299 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [1,1,0,0,0,0|0,0,0]=2 2300 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [1,1,0,0,0,0|1,0,0]=3 2301 B5R0.1 [C@H](C)(O)CC#N MCULE-6894178072 [1,1,0,0,0,0|1,0,1]=4 2302 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [1,1,0,0,0,0|0,0,0]=2 2303 B5R0.3 BrCC(Br)CBr MCULE-7323713039 [1,1,0,0,0,0|2,0,0]=4 2304 B5R0.3 C#CC(C)OC MCULE-3702592933 [1,1,0,0,0,0|1,0,1]=4 2305 B5R0.3 C#CC(C)OC MCULE-3806443816 [1,1,0,0,0,0|1,0,1]=4 2306 B5R0.3 C#CC(N)CC MCULE-2327605941 [1,1,0,0,0,0|1,0,1]=4 2307 B5R0.3 C#CC(N)CC MCULE-3572771620 [1,1,0,0,0,0|1,0,1]=4 2308 B5R0.3 C#CC(N)CO MCULE-2442851523 [1,1,0,0,0,0|0,0,2]=4 2309 B5R0.3 C#CC(N)CO MCULE-3866086926 [1,1,0,0,0,0|0,0,2]=4 2310 B5R0.3 C#CC(O)CC MCULE-9890863731 [1,1,0,0,0,0|1,0,1]=4 2311 B5R0.3 C#C[C@H](C)OC MCULE-9002531152 [1,1,0,0,0,0|1,0,1]=4 2312 B5R0.3 C#C[C@H](N)CO MCULE-2312982984 [1,1,0,0,0,0|0,0,2]=4 2313 B5R0.3 C#C[C@H](N)CO MCULE-8124038281 [1,1,0,0,0,0|0,0,2]=4 2314 B5R0.3 C#C[C@H](N)CO MCULE-8753140181 [1,1,0,0,0,0|0,0,2]=4 2315 B5R0.3 C#C[C@H](N)CO MCULE-9874393436 [1,1,0,0,0,0|0,0,2]=4 2316 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [1,1,0,0,0,0|1,0,1]=4 2317 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [1,1,0,0,0,0|1,0,1]=4 2318 B5R0.3 C=C(CC)CBr MCULE-1652422688 [1,1,0,0,0,0|1,0,1]=4 2319 B5R0.3 C=C(CC)CC MCULE-9174509622 [1,1,0,0,0,0|1,0,0]=3 2320 B5R0.3 C=C(CC)CN MCULE-2269385026 [1,1,0,0,0,0|1,0,1]=4 2321 B5R0.3 C=C(CC)CN MCULE-3033447984 [1,1,0,0,0,0|1,0,1]=4 2322 B5R0.3 C=C(CC)CO MCULE-8127766352 [1,1,0,0,0,0|0,0,1]=3 2323 B5R0.3 C=C(CO)CBr MCULE-9563589949 [1,1,0,0,0,0|1,0,1]=4 2324 B5R0.3 C=C(CO)CO MCULE-2682601949 [1,1,0,0,0,0|1,0,1]=4 2325 B5R0.3 C=CC(C)CC MCULE-8112547661 [1,1,0,0,0,0|1,0,1]=4 2326 B5R0.3 C=CC(N)CC MCULE-6270835453 [1,1,0,0,0,0|1,0,1]=4 2327 B5R0.3 C=CC(N)CC MCULE-7920121163 [1,1,0,0,0,0|1,0,1]=4 2328 B5R0.3 C=CC(N)CO MCULE-2457433196 [1,1,0,0,0,0|0,0,2]=4 2329 B5R0.3 C=CC(N)CO MCULE-6697949182 [1,1,0,0,0,0|0,0,2]=4 2330 B5R0.3 C=CC(N)CO MCULE-7137123222 [1,1,0,0,0,0|0,0,2]=4 2331 B5R0.3 C=CC(N)CO MCULE-8388687355 [1,1,0,0,0,0|0,0,2]=4 2332 B5R0.3 C=CC(O)CC MCULE-2794806228 [1,1,0,0,0,0|1,0,1]=4 2333 B5R0.3 C=CC(O)CO MCULE-6172654550 [1,1,0,0,0,0|0,0,2]=4 2334 B5R0.3 C=C[C@@H](N)CO MCULE-1000343618 [1,1,0,0,0,0|0,0,2]=4 2335 B5R0.3 C=C[C@@H](N)CO MCULE-1074988940 [1,1,0,0,0,0|0,0,2]=4 2336 B5R0.3 C=C[C@@H](N)CO MCULE-3685491078 [1,1,0,0,0,0|0,0,2]=4 2337 B5R0.3 C=C[C@@H](N)CO MCULE-4969611575 [1,1,0,0,0,0|0,0,2]=4 2338 B5R0.3 C=C[C@@H](O)CO MCULE-5957455616 [1,1,0,0,0,0|0,0,2]=4 2339 B5R0.3 C=C[C@H](N)CO MCULE-2834725512 [1,1,0,0,0,0|0,0,2]=4 2340 B5R0.3 C=C[C@H](N)CO MCULE-3281738311 [1,1,0,0,0,0|0,0,2]=4 2341 B5R0.3 C=C[C@H](N)CO MCULE-3551585090 [1,1,0,0,0,0|0,0,2]=4 2342 B5R0.3 C=C[C@H](N)CO MCULE-9055556349 [1,1,0,0,0,0|0,0,2]=4 2343 B5R0.3 C=C[C@H](O)CO MCULE-6068203844 [1,1,0,0,0,0|0,0,2]=4 2344 B5R0.3 C=C[C@H](O)CO MCULE-9367072182 [1,1,0,0,0,0|0,0,2]=4 2345 B5R0.3 CC(C#N)CO MCULE-1644391554 [1,1,0,0,0,0|1,0,1]=4 2346 B5R0.3 CC(CBr)CBr MCULE-7586113999 [1,1,0,0,0,0|2,0,0]=4 2347 B5R0.3 CC(CCl)CBr MCULE-5101754687 [1,1,0,0,0,0|2,0,0]=4 2348 B5R0.3 CC(CCl)CCl MCULE-1169456620 [1,1,0,0,0,0|2,0,0]=4 2349 B5R0.3 CC(CI)CI MCULE-4568725580 [1,1,0,0,0,0|2,0,0]=4 2350 B5R0.3 CC(CN)CCl MCULE-2423692318 [1,1,0,0,0,0|2,0,0]=4 2351 B5R0.3 CC(CN)CCl MCULE-8419541212 [1,1,0,0,0,0|2,0,0]=4 2352 B5R0.3 CC(CN)CN MCULE-1464804013 [1,1,0,0,0,0|2,0,0]=4 2353 B5R0.3 CC(CN)CN MCULE-3273307813 [1,1,0,0,0,0|2,0,0]=4 2354 B5R0.3 CC(CN)CO MCULE-5880795484 [1,1,0,0,0,0|1,0,0]=3 2355 B5R0.3 CC(CN)CO MCULE-8083007887 [1,1,0,0,0,0|1,0,0]=3 2356 B5R0.3 CC(CO)CBr MCULE-3815333295 [1,1,0,0,0,0|1,0,0]=3 2357 B5R0.3 CC(CO)CBr MCULE-5695891877 [1,1,0,0,0,0|1,0,0]=3 2358 B5R0.3 CC(CO)CO MCULE-2340730326 [1,1,0,0,0,0|1,0,0]=3 2359 B5R0.3 CC(CO)CS MCULE-1990992504 [1,1,0,0,0,0|1,0,0]=3 2360 B5R0.3 CC(CO)NN MCULE-3362748538 [1,1,0,0,0,0|2,0,0]=4 2361 B5R0.3 CC(CO)NN MCULE-4440318216 [1,1,0,0,0,0|2,0,0]=4 2362 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [1,1,0,0,0,0|1,0,1]=4 2363 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [1,1,0,0,0,0|1,0,1]=4 2364 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [1,1,0,0,0,0|1,0,1]=4 2365 B5R0.3 CC=C(C)CC MCULE-5790494157 [1,1,0,0,0,0|1,0,1]=4 2366 B5R0.3 CCC(=N)OC MCULE-4123543795 [1,1,0,0,0,0|1,0,1]=4 2367 B5R0.3 CCC(=N)OC MCULE-5346320805 [1,1,0,0,0,0|1,0,1]=4 2368 B5R0.3 CCC(=NO)C MCULE-1859652505 [1,1,0,0,0,0|1,0,1]=4 2369 B5R0.3 CCC(=O)CBr MCULE-7825573294 [1,1,0,0,0,0|1,0,1]=4 2370 B5R0.3 CCC(=O)CC MCULE-8236549739 [1,1,0,0,0,0|1,0,0]=3 2371 B5R0.3 CCC(=O)CCl MCULE-9019890380 [1,1,0,0,0,0|1,0,1]=4 2372 B5R0.3 CCC(=O)CN MCULE-1863418812 [1,1,0,0,0,0|1,0,1]=4 2373 B5R0.3 CCC(=O)CN MCULE-5831164340 [1,1,0,0,0,0|1,0,1]=4 2374 B5R0.3 CCC(=O)CO MCULE-8674894820 [1,1,0,0,0,0|0,0,1]=3 2375 B5R0.3 CCC(=O)NC MCULE-5612060170 [1,1,0,0,0,0|2,0,0]=4 2376 B5R0.3 CCC(=O)NO MCULE-1033164448 [1,1,0,0,0,0|1,0,1]=4 2377 B5R0.3 CCC(=O)OC MCULE-7384824725 [1,1,0,0,0,0|1,0,1]=4 2378 B5R0.3 CCC(=O)SC MCULE-9712192191 [1,1,0,0,0,0|2,0,0]=4 2379 B5R0.3 CCC(Br)C#N MCULE-4015907163 [1,1,0,0,0,0|1,0,1]=4 2380 B5R0.3 CCC(Br)C=O MCULE-3064952987 [1,1,0,0,0,0|0,0,2]=4 2381 B5R0.3 CCC(Br)CBr MCULE-5254958560 [1,1,0,0,0,0|1,0,0]=3 2382 B5R0.3 CCC(Br)CC MCULE-7435628721 [1,1,0,0,0,0|1,0,0]=3 2383 B5R0.3 CCC(Br)CO MCULE-7211805716 [1,1,0,0,0,0|0,0,0]=2 2384 B5R0.3 CCC(C)C#N MCULE-6204122967 [1,1,0,0,0,0|1,0,1]=4 2385 B5R0.3 CCC(C)C=O MCULE-2523669899 [1,1,0,0,0,0|0,0,2]=4 2386 B5R0.3 CCC(C)CBr MCULE-5451416952 [1,1,0,0,0,0|1,0,0]=3 2387 B5R0.3 CCC(C)CC MCULE-2542807917 [1,1,0,0,0,0|1,0,0]=3 2388 B5R0.3 CCC(C)CCl MCULE-7450386476 [1,1,0,0,0,0|1,0,0]=3 2389 B5R0.3 CCC(C)CI MCULE-5444509280 [1,1,0,0,0,0|1,0,0]=3 2390 B5R0.3 CCC(C)CN MCULE-2777327284 [1,1,0,0,0,0|1,0,0]=3 2391 B5R0.3 CCC(C)CN MCULE-7014901600 [1,1,0,0,0,0|1,0,0]=3 2392 B5R0.3 CCC(C)CO MCULE-6521026296 [1,1,0,0,0,0|0,0,0]=2 2393 B5R0.3 CCC(C)CS MCULE-7795095685 [1,1,0,0,0,0|0,1,0]=3 2394 B5R0.3 CCC(C)NC MCULE-2676584804 [1,1,0,0,0,0|2,0,0]=4 2395 B5R0.3 CCC(C)NC MCULE-6158046887 [1,1,0,0,0,0|2,0,0]=4 2396 B5R0.3 CCC(C)NN MCULE-6074476998 [1,1,0,0,0,0|2,0,0]=4 2397 B5R0.3 CCC(C)NN MCULE-8130021960 [1,1,0,0,0,0|2,0,0]=4 2398 B5R0.3 CCC(C)NN MCULE-8519369369 [1,1,0,0,0,0|2,0,0]=4 2399 B5R0.3 CCC(C)NO MCULE-1247092627 [1,1,0,0,0,0|1,0,0]=3 2400 B5R0.3 CCC(C)NO MCULE-6169819668 [1,1,0,0,0,0|1,0,0]=3 2401 B5R0.3 CCC(C)OC MCULE-7354431606 [1,1,0,0,0,0|1,0,0]=3 2402 B5R0.3 CCC(C)ON MCULE-2907890438 [1,1,0,0,0,0|2,0,0]=4 2403 B5R0.3 CCC(C)ON MCULE-4364205813 [1,1,0,0,0,0|2,0,0]=4 2404 B5R0.3 CCC(Cl)C#N MCULE-7185233128 [1,1,0,0,0,0|1,0,1]=4 2405 B5R0.3 CCC(Cl)C=O MCULE-5238776091 [1,1,0,0,0,0|0,0,2]=4 2406 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [1,1,0,0,0,0|1,0,0]=3 2407 B5R0.3 CCC(Cl)CO MCULE-1756262629 [1,1,0,0,0,0|0,0,0]=2 2408 B5R0.3 CCC(F)CBr MCULE-3226052264 [1,1,0,0,0,0|1,0,0]=3 2409 B5R0.3 CCC(F)CN MCULE-1291385596 [1,1,0,0,0,0|1,0,0]=3 2410 B5R0.3 CCC(F)CN MCULE-7421331323 [1,1,0,0,0,0|1,0,0]=3 2411 B5R0.3 CCC(I)CC MCULE-1119844552 [1,1,0,0,0,0|1,0,0]=3 2412 B5R0.3 CCC(N)C#N MCULE-1350483203 [1,1,0,0,0,0|1,0,1]=4 2413 B5R0.3 CCC(N)C#N MCULE-3867024162 [1,1,0,0,0,0|1,0,1]=4 2414 B5R0.3 CCC(N)CBr MCULE-3567691924 [1,1,0,0,0,0|1,0,0]=3 2415 B5R0.3 CCC(N)CC MCULE-4261937519 [1,1,0,0,0,0|1,0,0]=3 2416 B5R0.3 CCC(N)CC MCULE-5899128891 [1,1,0,0,0,0|1,0,0]=3 2417 B5R0.3 CCC(N)CN MCULE-6911484065 [1,1,0,0,0,0|1,0,0]=3 2418 B5R0.3 CCC(N)CN MCULE-8376506697 [1,1,0,0,0,0|1,0,0]=3 2419 B5R0.3 CCC(N)CO MCULE-1135809021 [1,1,0,0,0,0|0,0,0]=2 2420 B5R0.3 CCC(N)CO MCULE-7588854111 [1,1,0,0,0,0|0,0,0]=2 2421 B5R0.3 CCC(O)C#N MCULE-5389816542 [1,1,0,0,0,0|1,0,1]=4 2422 B5R0.3 CCC(O)CBr MCULE-4205031860 [1,1,0,0,0,0|1,0,0]=3 2423 B5R0.3 CCC(O)CC MCULE-5553645045 [1,1,0,0,0,0|1,0,0]=3 2424 B5R0.3 CCC(O)CCl MCULE-8359810208 [1,1,0,0,0,0|1,0,0]=3 2425 B5R0.3 CCC(O)CN MCULE-5197026448 [1,1,0,0,0,0|1,0,0]=3 2426 B5R0.3 CCC(O)CO MCULE-2488753438 [1,1,0,0,0,0|0,0,0]=2 2427 B5R0.3 CCC(O)CO MCULE-7297282094 [1,1,0,0,0,0|0,0,0]=2 2428 B5R0.3 CCC(S)CC MCULE-2556259434 [1,1,0,0,0,0|1,0,0]=3 2429 B5R0.3 CCC(S)CS MCULE-9332449950 [1,1,0,0,0,0|0,1,0]=3 2430 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [1,1,0,0,0,0|1,0,0]=3 2431 B5R0.3 CCN(C)CC MCULE-7207964917 [1,1,0,0,0,0|1,0,0]=3 2432 B5R0.3 CCN(N)CC MCULE-9853386945 [1,1,0,0,0,0|1,0,0]=3 2433 B5R0.3 CCN(N)CC MCULE-9962617398 [1,1,0,0,0,0|1,0,0]=3 2434 B5R0.3 CCN(O)CC MCULE-6022935768 [1,1,0,0,0,0|1,0,0]=3 2435 B5R0.3 CCP(=O)CC MCULE-2216184595 [1,1,0,0,0,0|1,0,0]=3 2436 B5R0.3 CCP(Cl)CC MCULE-4484529264 [1,1,0,0,0,0|1,0,0]=3 2437 B5R0.3 CCS(=O)CC MCULE-5102735179 [1,1,0,0,0,0|0,1,0]=3 2438 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [1,1,0,0,0,0|1,0,0]=3 2439 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [1,1,0,0,0,0|1,0,0]=3 2440 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [1,1,0,0,0,0|0,0,0]=2 2441 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [1,1,0,0,0,0|0,0,0]=2 2442 B5R0.3 CC[C@@H](N)C#N MCULE-3696119254 [1,1,0,0,0,0|1,0,1]=4 2443 B5R0.3 CC[C@@H](N)C#N MCULE-5586041766 [1,1,0,0,0,0|1,0,1]=4 2444 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [1,1,0,0,0,0|0,0,0]=2 2445 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [1,1,0,0,0,0|0,0,0]=2 2446 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [1,1,0,0,0,0|1,0,0]=3 2447 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [1,1,0,0,0,0|1,0,0]=3 2448 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [1,1,0,0,0,0|0,0,0]=2 2449 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [1,1,0,0,0,0|0,0,0]=2 2450 B5R0.3 CC[C@H](C)C#N MCULE-9118306872 [1,1,0,0,0,0|1,0,1]=4 2451 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [1,1,0,0,0,0|1,0,0]=3 2452 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [1,1,0,0,0,0|1,0,0]=3 2453 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [1,1,0,0,0,0|1,0,0]=3 2454 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [1,1,0,0,0,0|1,0,0]=3 2455 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [1,1,0,0,0,0|1,0,0]=3 2456 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [1,1,0,0,0,0|1,0,0]=3 2457 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [1,1,0,0,0,0|1,0,0]=3 2458 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [1,1,0,0,0,0|1,0,0]=3 2459 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [1,1,0,0,0,0|1,0,0]=3 2460 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [1,1,0,0,0,0|0,0,0]=2 2461 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [1,1,0,0,0,0|0,0,0]=2 2462 B5R0.3 CC[C@H](N)C#N MCULE-4431283179 [1,1,0,0,0,0|1,0,1]=4 2463 B5R0.3 CC[C@H](N)C#N MCULE-8842235277 [1,1,0,0,0,0|1,0,1]=4 2464 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [1,1,0,0,0,0|1,0,0]=3 2465 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [1,1,0,0,0,0|1,0,0]=3 2466 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [1,1,0,0,0,0|0,0,0]=2 2467 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [1,1,0,0,0,0|0,0,0]=2 2468 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [1,1,0,0,0,0|1,0,0]=3 2469 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [1,1,0,0,0,0|0,0,0]=2 2470 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [1,1,0,0,0,0|0,0,0]=2 2471 B5R0.3 CNC(=N)CO MCULE-3239749882 [1,1,0,0,0,0|1,0,1]=4 2472 B5R0.3 CNC(=O)CO MCULE-5899226107 [1,1,0,0,0,0|1,0,1]=4 2473 B5R0.3 CNC(C)CN MCULE-1599162912 [1,1,0,0,0,0|2,0,0]=4 2474 B5R0.3 CNC(C)CN MCULE-1637391260 [1,1,0,0,0,0|2,0,0]=4 2475 B5R0.3 CNC(C)CO MCULE-3841057780 [1,1,0,0,0,0|1,0,0]=3 2476 B5R0.3 CNC(C)CO MCULE-6474892275 [1,1,0,0,0,0|1,0,0]=3 2477 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [1,1,0,0,0,0|1,0,0]=3 2478 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [1,1,0,0,0,0|1,0,0]=3 2479 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [1,1,0,0,0,0|1,0,0]=3 2480 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [1,1,0,0,0,0|1,0,0]=3 2481 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [1,1,0,0,0,0|1,0,0]=3 2482 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [1,1,0,0,0,0|1,0,0]=3 2483 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [1,1,0,0,0,0|1,0,0]=3 2484 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [1,1,0,0,0,0|1,0,0]=3 2485 B5R0.3 COC(=N)CCl MCULE-2713131753 [1,1,0,0,0,0|1,0,1]=4 2486 B5R0.3 COC(=N)CCl MCULE-6471252676 [1,1,0,0,0,0|1,0,1]=4 2487 B5R0.3 COC(=O)CBr MCULE-2684954408 [1,1,0,0,0,0|1,0,1]=4 2488 B5R0.3 COC(=O)CCl MCULE-5886832940 [1,1,0,0,0,0|1,0,1]=4 2489 B5R0.3 COC(=O)CF MCULE-4367430175 [1,1,0,0,0,0|1,0,1]=4 2490 B5R0.3 COC(=O)CI MCULE-9545584156 [1,1,0,0,0,0|1,0,1]=4 2491 B5R0.3 COC(=O)CN MCULE-7462799100 [1,1,0,0,0,0|1,0,1]=4 2492 B5R0.3 COC(=O)CN MCULE-8887061469 [1,1,0,0,0,0|1,0,1]=4 2493 B5R0.3 COC(=O)CO MCULE-8734582763 [1,1,0,0,0,0|0,0,1]=3 2494 B5R0.3 COC(=O)CS MCULE-3020830180 [1,1,0,0,0,0|0,1,1]=4 2495 B5R0.3 COC(C)C#N MCULE-7716445717 [1,1,0,0,0,0|1,0,1]=4 2496 B5R0.3 COC(C)CBr MCULE-6831960550 [1,1,0,0,0,0|1,0,0]=3 2497 B5R0.3 COC(C)CCl MCULE-6614968111 [1,1,0,0,0,0|1,0,0]=3 2498 B5R0.3 COC(C)CI MCULE-9561627722 [1,1,0,0,0,0|1,0,0]=3 2499 B5R0.3 COC(C)CN MCULE-1378513525 [1,1,0,0,0,0|1,0,0]=3 2500 B5R0.3 COC(C)CN MCULE-6114730248 [1,1,0,0,0,0|1,0,0]=3 2501 B5R0.3 COC(C)CN MCULE-7516064224 [1,1,0,0,0,0|1,0,0]=3 2502 B5R0.3 COC(C)CN MCULE-8277408054 [1,1,0,0,0,0|1,0,0]=3 2503 B5R0.3 COC(C)CO MCULE-5269990702 [1,1,0,0,0,0|0,0,0]=2 2504 B5R0.3 COC(C)CO MCULE-7173093332 [1,1,0,0,0,0|0,0,0]=2 2505 B5R0.3 COC(C)OC MCULE-8241616143 [1,1,0,0,0,0|2,0,0]=4 2506 B5R0.3 CO[C@@H](C)C#N MCULE-1453263443 [1,1,0,0,0,0|1,0,1]=4 2507 B5R0.3 CO[C@@H](C)CN MCULE-1448950160 [1,1,0,0,0,0|1,0,0]=3 2508 B5R0.3 CO[C@@H](C)CN MCULE-3784073249 [1,1,0,0,0,0|1,0,0]=3 2509 B5R0.3 CO[C@@H](C)CN MCULE-6073633931 [1,1,0,0,0,0|1,0,0]=3 2510 B5R0.3 CO[C@@H](C)CN MCULE-9516756218 [1,1,0,0,0,0|1,0,0]=3 2511 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [1,1,0,0,0,0|0,0,0]=2 2512 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [1,1,0,0,0,0|0,0,0]=2 2513 B5R0.3 CO[C@H](C)CN MCULE-4143562009 [1,1,0,0,0,0|1,0,0]=3 2514 B5R0.3 CO[C@H](C)CN MCULE-4184510827 [1,1,0,0,0,0|1,0,0]=3 2515 B5R0.3 CO[C@H](C)CN MCULE-9625722424 [1,1,0,0,0,0|1,0,0]=3 2516 B5R0.3 CO[C@H](C)CN MCULE-9882567615 [1,1,0,0,0,0|1,0,0]=3 2517 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [1,1,0,0,0,0|0,0,0]=2 2518 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [1,1,0,0,0,0|0,0,0]=2 2519 B5R0.3 CSC(C)CN MCULE-8841622109 [1,1,0,0,0,0|1,1,0]=4 2520 B5R0.3 CSC(C)CO MCULE-4646435737 [1,1,0,0,0,0|0,1,0]=3 2521 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [1,1,0,0,0,0|1,0,0]=3 2522 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [1,1,0,0,0,0|1,0,0]=3 2523 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [1,1,0,0,0,0|1,0,0]=3 2524 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [1,1,0,0,0,0|1,0,0]=3 2525 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [1,1,0,0,0,0|1,0,0]=3 2526 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [1,1,0,0,0,0|1,0,0]=3 2527 B5R0.3 ClCC(Br)CBr MCULE-2454576835 [1,1,0,0,0,0|2,0,0]=4 2528 B5R0.3 ClCC(Cl)CCl MCULE-3839333809 [1,1,0,0,0,0|2,0,0]=4 2529 B5R0.3 FCC(Br)CBr MCULE-3296621964 [1,1,0,0,0,0|2,0,0]=4 2530 B5R0.3 FCC(Cl)CF MCULE-6083002482 [1,1,0,0,0,0|2,0,0]=4 2531 B5R0.3 FCC(I)CF MCULE-1837926612 [1,1,0,0,0,0|2,0,0]=4 2532 B5R0.3 N#CC(N)CO MCULE-5918855868 [1,1,0,0,0,0|1,0,1]=4 2533 B5R0.3 N#CC(N)CO MCULE-8439000158 [1,1,0,0,0,0|1,0,1]=4 2534 B5R0.3 NC(CF)CF MCULE-4671221738 [1,1,0,0,0,0|2,0,0]=4 2535 B5R0.3 NC(CF)CF MCULE-8916274721 [1,1,0,0,0,0|2,0,0]=4 2536 B5R0.3 NC(CO)CF MCULE-3756808200 [1,1,0,0,0,0|1,0,0]=3 2537 B5R0.3 NC(CO)CF MCULE-9468719402 [1,1,0,0,0,0|1,0,0]=3 2538 B5R0.3 NC(CO)CO MCULE-1559988016 [1,1,0,0,0,0|1,0,0]=3 2539 B5R0.3 NC(CO)CO MCULE-4954119952 [1,1,0,0,0,0|1,0,0]=3 2540 B5R0.3 NCC(Br)CBr MCULE-4507622045 [1,1,0,0,0,0|2,0,0]=4 2541 B5R0.3 NCC(Br)CBr MCULE-9707598399 [1,1,0,0,0,0|2,0,0]=4 2542 B5R0.3 NCC(F)CN MCULE-8855486562 [1,1,0,0,0,0|2,0,0]=4 2543 B5R0.3 NCC(F)CO MCULE-6156319956 [1,1,0,0,0,0|1,0,0]=3 2544 B5R0.3 NCC(F)CO MCULE-7472307328 [1,1,0,0,0,0|1,0,0]=3 2545 B5R0.3 NCC(O)CCl MCULE-1566349721 [1,1,0,0,0,0|2,0,0]=4 2546 B5R0.3 NCC(O)CCl MCULE-3532626994 [1,1,0,0,0,0|2,0,0]=4 2547 B5R0.3 NCC(O)CCl MCULE-5045913208 [1,1,0,0,0,0|2,0,0]=4 2548 B5R0.3 NCC(O)CCl MCULE-7168455596 [1,1,0,0,0,0|2,0,0]=4 2549 B5R0.3 NCC(O)CF MCULE-7529777116 [1,1,0,0,0,0|2,0,0]=4 2550 B5R0.3 NCC(O)CF MCULE-8092861019 [1,1,0,0,0,0|2,0,0]=4 2551 B5R0.3 NCC(O)CN MCULE-4689186078 [1,1,0,0,0,0|2,0,0]=4 2552 B5R0.3 NCC(O)CO MCULE-2689763818 [1,1,0,0,0,0|1,0,0]=3 2553 B5R0.3 NCC(O)CO MCULE-6096620010 [1,1,0,0,0,0|1,0,0]=3 2554 B5R0.3 NCC(O)CO MCULE-7307777212 [1,1,0,0,0,0|1,0,0]=3 2555 B5R0.3 NC[C@@H](F)CO MCULE-3273711180 [1,1,0,0,0,0|1,0,0]=3 2556 B5R0.3 NC[C@@H](F)CO MCULE-6673969522 [1,1,0,0,0,0|1,0,0]=3 2557 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [1,1,0,0,0,0|1,0,0]=3 2558 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [1,1,0,0,0,0|1,0,0]=3 2559 B5R0.3 NC[C@@H](O)CCl MCULE-1905964392 [1,1,0,0,0,0|2,0,0]=4 2560 B5R0.3 NC[C@@H](O)CCl MCULE-5592096864 [1,1,0,0,0,0|2,0,0]=4 2561 B5R0.3 NC[C@@H](O)CCl MCULE-5723497450 [1,1,0,0,0,0|2,0,0]=4 2562 B5R0.3 NC[C@@H](O)CCl MCULE-7112738263 [1,1,0,0,0,0|2,0,0]=4 2563 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [1,1,0,0,0,0|1,0,0]=3 2564 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [1,1,0,0,0,0|1,0,0]=3 2565 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [1,1,0,0,0,0|1,0,0]=3 2566 B5R0.3 NC[C@H](F)CO MCULE-2595736378 [1,1,0,0,0,0|1,0,0]=3 2567 B5R0.3 NC[C@H](F)CO MCULE-7417074078 [1,1,0,0,0,0|1,0,0]=3 2568 B5R0.3 NC[C@H](F)CO MCULE-7938231499 [1,1,0,0,0,0|1,0,0]=3 2569 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [1,1,0,0,0,0|1,0,0]=3 2570 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [1,1,0,0,0,0|1,0,0]=3 2571 B5R0.3 NC[C@H](O)CBr MCULE-4679771824 [1,1,0,0,0,0|2,0,0]=4 2572 B5R0.3 NC[C@H](O)CBr MCULE-4785059460 [1,1,0,0,0,0|2,0,0]=4 2573 B5R0.3 NC[C@H](O)CCl MCULE-3625478007 [1,1,0,0,0,0|2,0,0]=4 2574 B5R0.3 NC[C@H](O)CCl MCULE-6692503791 [1,1,0,0,0,0|2,0,0]=4 2575 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [1,1,0,0,0,0|1,0,0]=3 2576 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [1,1,0,0,0,0|1,0,0]=3 2577 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [1,1,0,0,0,0|1,0,0]=3 2578 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [1,1,0,0,0,0|1,0,0]=3 2579 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [1,1,0,0,0,0|1,0,0]=3 2580 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [1,1,0,0,0,0|1,0,0]=3 2581 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [1,1,0,0,0,0|1,0,0]=3 2582 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [1,1,0,0,0,0|1,0,0]=3 2583 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [1,1,0,0,0,0|1,0,0]=3 2584 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [1,1,0,0,0,0|1,0,0]=3 2585 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [1,1,0,0,0,0|1,0,0]=3 2586 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [1,1,0,0,0,0|1,0,0]=3 2587 B5R0.3 O=C(CO)CO MCULE-7188810449 [1,1,0,0,0,0|1,0,1]=4 2588 B5R0.3 O=CC(O)CO MCULE-9581740191 [1,1,0,0,0,0|1,0,1]=4 2589 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [1,1,0,0,0,0|1,0,1]=4 2590 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [1,1,0,0,0,0|1,0,1]=4 2591 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [1,1,0,0,0,0|1,0,1]=4 2592 B5R0.3 OC(CBr)CBr MCULE-9071238259 [1,1,0,0,0,0|2,0,0]=4 2593 B5R0.3 OC(CCl)CBr MCULE-3844020597 [1,1,0,0,0,0|2,0,0]=4 2594 B5R0.3 OC(CCl)CCl MCULE-7873018520 [1,1,0,0,0,0|2,0,0]=4 2595 B5R0.3 OC(CCl)CI MCULE-3276637880 [1,1,0,0,0,0|2,0,0]=4 2596 B5R0.3 OC(CF)CBr MCULE-3915880352 [1,1,0,0,0,0|2,0,0]=4 2597 B5R0.3 OC(CF)CCl MCULE-6441743377 [1,1,0,0,0,0|2,0,0]=4 2598 B5R0.3 OC(CF)CF MCULE-3360341794 [1,1,0,0,0,0|2,0,0]=4 2599 B5R0.3 OC(CI)CI MCULE-6842895270 [1,1,0,0,0,0|2,0,0]=4 2600 B5R0.3 OCC(Br)CBr MCULE-9616107956 [1,1,0,0,0,0|1,0,0]=3 2601 B5R0.3 OCC(Br)CO MCULE-9272628834 [1,1,0,0,0,0|1,0,0]=3 2602 B5R0.3 OCC(Cl)CCl MCULE-2120585852 [1,1,0,0,0,0|1,0,0]=3 2603 B5R0.3 OCC(Cl)CO MCULE-7487945326 [1,1,0,0,0,0|1,0,0]=3 2604 B5R0.3 OCC(F)CBr MCULE-2889937576 [1,1,0,0,0,0|1,0,0]=3 2605 B5R0.3 OCC(F)CO MCULE-2970537690 [1,1,0,0,0,0|1,0,0]=3 2606 B5R0.3 OCC(O)CBr MCULE-9116190245 [1,1,0,0,0,0|1,0,0]=3 2607 B5R0.3 OCC(O)CCl MCULE-7895191088 [1,1,0,0,0,0|1,0,0]=3 2608 B5R0.3 OCC(O)CCl MCULE-8992242488 [1,1,0,0,0,0|1,0,0]=3 2609 B5R0.3 OCC(O)CF MCULE-3575952891 [1,1,0,0,0,0|1,0,0]=3 2610 B5R0.3 OCC(O)CF MCULE-8981430411 [1,1,0,0,0,0|1,0,0]=3 2611 B5R0.3 OCC(O)CI MCULE-6705992930 [1,1,0,0,0,0|1,0,0]=3 2612 B5R0.3 OCC(O)CO MCULE-6349111826 [1,1,0,0,0,0|1,0,0]=3 2613 B5R0.3 OCC(O)CS MCULE-6300188207 [1,1,0,0,0,0|1,0,0]=3 2614 B5R0.3 OCC(S)CS MCULE-9735516119 [1,1,0,0,0,0|1,0,0]=3 2615 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [1,1,0,0,0,0|1,0,0]=3 2616 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [1,1,0,0,0,0|1,0,0]=3 2617 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [1,1,0,0,0,0|1,0,0]=3 2618 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [1,1,0,0,0,0|1,0,0]=3 2619 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [1,1,0,0,0,0|1,0,0]=3 2620 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [1,1,0,0,0,0|1,0,0]=3 2621 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [1,1,0,0,0,0|1,0,0]=3 2622 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [1,1,0,0,0,0|1,0,0]=3 2623 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [1,1,0,0,0,0|1,0,0]=3 2624 B5R0.3 O[C@@H](CCl)CI MCULE-5324720097 [1,1,0,0,0,0|2,0,0]=4 2625 B5R0.3 O[C@H](CCl)CI MCULE-2790157830 [1,1,0,0,0,0|2,0,0]=4 2626 B5R0.3 [C@H](O)(CN)CCl MCULE-1220791610 [1,1,0,0,0,0|2,0,0]=4 2627 B5R0.3 [C@H](O)(CN)CCl MCULE-4106901858 [1,1,0,0,0,0|2,0,0]=4 2628 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [0,2,0,0,0,0|1,0,1]=4 2629 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [0,2,0,0,0,0|1,0,1]=4 2630 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [0,2,0,0,0,0|1,0,1]=4 2631 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [0,2,0,0,0,0|1,0,1]=4 2632 B7R0.2 CC(=O)OC(Br)CBr MCULE-7215936142 [0,2,0,0,0,0|1,0,1]=4 2633 B7R0.2 CC(C)/C=C(\F)/CO MCULE-5089231546 [0,2,0,0,0,0|1,0,1]=4 2634 B7R0.2 CC(C)CC(C)CBr MCULE-6800285380 [0,2,0,0,0,0|2,0,0]=4 2635 B7R0.2 CC(C)CC(C)CO MCULE-5856507691 [0,2,0,0,0,0|1,0,0]=3 2636 B7R0.2 CC(C)CC(N)CF MCULE-3937400151 [0,2,0,0,0,0|2,0,0]=4 2637 B7R0.2 CC(C)CC(N)CF MCULE-7951827838 [0,2,0,0,0,0|2,0,0]=4 2638 B7R0.2 CC(C)CC(N)CN MCULE-3441513735 [0,2,0,0,0,0|2,0,0]=4 2639 B7R0.2 CC(C)CC(N)CO MCULE-6347344178 [0,2,0,0,0,0|1,0,0]=3 2640 B7R0.2 CC(C)CC(N)CO MCULE-7024759986 [0,2,0,0,0,0|1,0,0]=3 2641 B7R0.2 CC(C)CC(N)CS MCULE-8932651812 [0,2,0,0,0,0|1,1,0]=4 2642 B7R0.2 CC(C)CC(O)CN MCULE-9414833333 [0,2,0,0,0,0|2,0,0]=4 2643 B7R0.2 CC(C)CC(O)CN MCULE-9784331526 [0,2,0,0,0,0|2,0,0]=4 2644 B7R0.2 CC(C)C[C@@H](N)CBr MCULE-4869966214 [0,2,0,0,0,0|2,0,0]=4 2645 B7R0.2 CC(C)C[C@@H](N)CO MCULE-1979401982 [0,2,0,0,0,0|1,0,0]=3 2646 B7R0.2 CC(C)C[C@@H](N)CO MCULE-3025407298 [0,2,0,0,0,0|1,0,0]=3 2647 B7R0.2 CC(C)C[C@H](N)CBr MCULE-4224057266 [0,2,0,0,0,0|2,0,0]=4 2648 B7R0.2 CC(C)C[C@H](N)CO MCULE-2790872575 [0,2,0,0,0,0|1,0,0]=3 2649 B7R0.2 CC(C)C[C@H](N)CO MCULE-9198147139 [0,2,0,0,0,0|1,0,0]=3 2650 B7R0.2 CC(C)NC(=O)CO MCULE-5386700783 [0,2,0,0,0,0|1,0,1]=4 2651 B7R0.2 CC(C)OC(=O)CBr MCULE-1610339208 [0,2,0,0,0,0|1,0,1]=4 2652 B7R0.2 CC(C)OC(=O)CCl MCULE-3017211046 [0,2,0,0,0,0|1,0,1]=4 2653 B7R0.2 CC(C)OC(=O)CN MCULE-4475626262 [0,2,0,0,0,0|1,0,1]=4 2654 B7R0.2 CC(C)OC(=O)CN MCULE-5696337645 [0,2,0,0,0,0|1,0,1]=4 2655 B7R0.2 CC(C)OC(=O)CO MCULE-4694316703 [0,2,0,0,0,0|0,0,1]=3 2656 B7R0.2 CC(C)OC(=O)CS MCULE-5298940210 [0,2,0,0,0,0|0,1,1]=4 2657 B7R0.2 CC(CO)CC(F)F MCULE-1470130605 [0,2,0,0,0,0|2,0,0]=4 2658 B7R0.2 CC(CO)CN(C)C MCULE-3103307387 [0,2,0,0,0,0|2,0,0]=4 2659 B7R0.2 CC(O)CC(C)CN MCULE-3086796159 [0,2,0,0,0,0|2,0,0]=4 2660 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [0,2,0,0,0,0|1,0,1]=4 2661 B7R0.2 CCC(=O)CC(C)C MCULE-8378320990 [0,2,0,0,0,0|2,0,0]=4 2662 B7R0.2 CCC(=O)OC(C)C MCULE-6546381101 [0,2,0,0,0,0|1,0,1]=4 2663 B7R0.2 CCC(C)CB(O)O MCULE-4978906892 [0,2,0,0,0,0|2,0,0]=4 2664 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [0,2,0,0,0,0|1,0,1]=4 2665 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [0,2,0,0,0,0|1,0,1]=4 2666 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [0,2,0,0,0,0|2,0,0]=4 2667 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [0,2,0,0,0,0|2,0,0]=4 2668 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [0,2,0,0,0,0|2,0,0]=4 2669 B7R0.2 CCC(C)OC(=O)C MCULE-8410375215 [0,2,0,0,0,0|1,0,1]=4 2670 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [0,2,0,0,0,0|1,0,1]=4 2671 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [0,2,0,0,0,0|1,0,1]=4 2672 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [0,2,0,0,0,0|1,0,0]=3 2673 B7R0.2 CCC(O)CC(=O)O MCULE-4663578527 [0,2,0,0,0,0|1,0,1]=4 2674 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [0,2,0,0,0,0|1,0,0]=3 2675 B7R0.2 CCN(C)CC(=O)O MCULE-3102395413 [0,2,0,0,0,0|1,0,1]=4 2676 B7R0.2 CCS(=O)CC(=O)O MCULE-5648298475 [0,2,0,0,0,0|0,1,1]=4 2677 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [0,2,0,0,0,0|1,0,1]=4 2678 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [0,2,0,0,0,0|1,0,1]=4 2679 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [0,2,0,0,0,0|1,0,1]=4 2680 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [0,2,0,0,0,0|1,0,1]=4 2681 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [0,2,0,0,0,0|1,0,1]=4 2682 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [0,2,0,0,0,0|1,0,1]=4 2683 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [0,2,0,0,0,0|1,0,1]=4 2684 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [0,2,0,0,0,0|1,0,1]=4 2685 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [0,2,0,0,0,0|1,0,1]=4 2686 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [0,2,0,0,0,0|1,0,1]=4 2687 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [0,2,0,0,0,0|1,0,1]=4 2688 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [0,2,0,0,0,0|1,0,1]=4 2689 B7R0.2 CN(C)CC(N)CO MCULE-2789134862 [0,2,0,0,0,0|2,0,0]=4 2690 B7R0.2 CN(C)CC(N)CO MCULE-4090276677 [0,2,0,0,0,0|2,0,0]=4 2691 B7R0.2 CN(C)CC(O)CO MCULE-3436894516 [0,2,0,0,0,0|2,0,0]=4 2692 B7R0.2 CN(C)C[C@@H](O)CO MCULE-7101033572 [0,2,0,0,0,0|2,0,0]=4 2693 B7R0.2 CN(C)C[C@H](O)CO MCULE-4297947949 [0,2,0,0,0,0|2,0,0]=4 2694 B7R0.2 COC(=O)CC(C)O MCULE-7542131760 [0,2,0,0,0,0|2,0,0]=4 2695 B7R0.2 COC(=O)CC(C)O MCULE-7559608260 [0,2,0,0,0,0|2,0,0]=4 2696 B7R0.2 COC(=O)C[C@@H](C)O MCULE-1647366037 [0,2,0,0,0,0|2,0,0]=4 2697 B7R0.2 COC(=O)C[C@@H](C)O MCULE-7832771936 [0,2,0,0,0,0|2,0,0]=4 2698 B7R0.2 COC(=O)C[C@H](C)O MCULE-5154734951 [0,2,0,0,0,0|2,0,0]=4 2699 B7R0.2 COC(=O)C[C@H](C)O MCULE-7031738180 [0,2,0,0,0,0|2,0,0]=4 2700 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [0,2,0,0,0,0|2,0,0]=4 2701 B7R0.2 NC(CO)CC(F)F MCULE-5033329865 [0,2,0,0,0,0|2,0,0]=4 2702 B7R0.2 NC(CO)CC(F)F MCULE-6986507912 [0,2,0,0,0,0|2,0,0]=4 2703 B7R0.3 C#CC(O)CCCC MCULE-8547184224 [0,2,0,0,0,0|1,0,0]=3 2704 B7R0.3 C#CCCC(O)CC MCULE-2969540863 [0,2,0,0,0,0|2,0,0]=4 2705 B7R0.3 C#CCC[C@@H](N)CO MCULE-6761945465 [0,2,0,0,0,0|1,0,1]=4 2706 B7R0.3 C#CCC[C@@H](N)CO MCULE-9589288760 [0,2,0,0,0,0|1,0,1]=4 2707 B7R0.3 C#CCC[C@H](N)CO MCULE-5308019604 [0,2,0,0,0,0|1,0,1]=4 2708 B7R0.3 C#CCC[C@H](N)CO MCULE-7191637286 [0,2,0,0,0,0|1,0,1]=4 2709 B7R0.3 C#CCOC(=O)CC MCULE-9368945481 [0,2,0,0,0,0|1,0,1]=4 2710 B7R0.3 C#CCOC(C)CO MCULE-5112536028 [0,2,0,0,0,0|0,0,1]=3 2711 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [0,2,0,0,0,0|2,0,0]=4 2712 B7R0.3 C=C(CCl)OCOC MCULE-3049043061 [0,2,0,0,0,0|1,0,1]=4 2713 B7R0.3 C=CC(=O)OCCO MCULE-3147939665 [0,2,0,0,0,0|0,0,2]=4 2714 B7R0.3 C=CC(O)CCCC MCULE-1674668011 [0,2,0,0,0,0|1,0,0]=3 2715 B7R0.3 C=CCCC(=O)CC MCULE-7933484898 [0,2,0,0,0,0|2,0,0]=4 2716 B7R0.3 C=CCCC(N)CC MCULE-4520234599 [0,2,0,0,0,0|2,0,0]=4 2717 B7R0.3 C=CCCC(N)CC MCULE-9493759139 [0,2,0,0,0,0|2,0,0]=4 2718 B7R0.3 C=CCCC(N)CO MCULE-2658614123 [0,2,0,0,0,0|1,0,1]=4 2719 B7R0.3 C=CCCC(O)CC MCULE-1265881694 [0,2,0,0,0,0|2,0,0]=4 2720 B7R0.3 C=CCC[C@@H](O)CO MCULE-6352864696 [0,2,0,0,0,0|1,0,1]=4 2721 B7R0.3 C=CCOC(C)CN MCULE-7634569955 [0,2,0,0,0,0|1,0,1]=4 2722 B7R0.3 C=CCO[C@@H](C)CN MCULE-4623222070 [0,2,0,0,0,0|1,0,1]=4 2723 B7R0.3 C=CCO[C@@H](C)CO MCULE-6699692288 [0,2,0,0,0,0|0,0,1]=3 2724 B7R0.3 CC#CCC(N)CO MCULE-1082443924 [0,2,0,0,0,0|1,0,1]=4 2725 B7R0.3 CC#CCC(O)CC MCULE-3474605709 [0,2,0,0,0,0|1,0,1]=4 2726 B7R0.3 CC(C#N)OCCBr MCULE-3358143980 [0,2,0,0,0,0|1,0,0]=3 2727 B7R0.3 CC(CBr)OCCBr MCULE-2889401501 [0,2,0,0,0,0|1,0,0]=3 2728 B7R0.3 CC(CCCO)NN MCULE-8201748999 [0,2,0,0,0,0|1,0,0]=3 2729 B7R0.3 CC(CN)CCCN MCULE-1249275042 [0,2,0,0,0,0|2,0,0]=4 2730 B7R0.3 CC(CN)CCCO MCULE-2908684674 [0,2,0,0,0,0|1,0,0]=3 2731 B7R0.3 CC(CN)CCCO MCULE-5608783947 [0,2,0,0,0,0|1,0,0]=3 2732 B7R0.3 CC(CN)CCCO MCULE-9269954426 [0,2,0,0,0,0|1,0,0]=3 2733 B7R0.3 CC(CO)CCCO MCULE-8589885622 [0,2,0,0,0,0|1,0,0]=3 2734 B7R0.3 CC(CO)NCCO MCULE-5180763491 [0,2,0,0,0,0|1,0,0]=3 2735 B7R0.3 CC/C=C/C(C)CC MCULE-2438890702 [0,2,0,0,0,0|2,0,0]=4 2736 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [0,2,0,0,0,0|2,0,0]=4 2737 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [0,2,0,0,0,0|2,0,0]=4 2738 B7R0.3 CCC(=O)NCCN MCULE-3384406070 [0,2,0,0,0,0|2,0,0]=4 2739 B7R0.3 CCC(=O)NCCN MCULE-3992696592 [0,2,0,0,0,0|2,0,0]=4 2740 B7R0.3 CCC(=O)NCCN MCULE-4556462042 [0,2,0,0,0,0|2,0,0]=4 2741 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [0,2,0,0,0,0|1,0,0]=3 2742 B7R0.3 CCC(=O)OCCCl MCULE-7825392065 [0,2,0,0,0,0|1,0,0]=3 2743 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [0,2,0,0,0,0|0,0,0]=2 2744 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [0,2,0,0,0,0|1,0,1]=4 2745 B7R0.3 CCC(C)CCCO MCULE-2323419626 [0,2,0,0,0,0|1,0,0]=3 2746 B7R0.3 CCC(C)NCCO MCULE-1340916666 [0,2,0,0,0,0|1,0,0]=3 2747 B7R0.3 CCC(Cl)CCCCl MCULE-6770226574 [0,2,0,0,0,0|2,0,0]=4 2748 B7R0.3 CCC(N)CCCO MCULE-3868205501 [0,2,0,0,0,0|1,0,0]=3 2749 B7R0.3 CCC(N)CCOC MCULE-8279767210 [0,2,0,0,0,0|1,0,0]=3 2750 B7R0.3 CCC(O)CCCN MCULE-1491163174 [0,2,0,0,0,0|2,0,0]=4 2751 B7R0.3 CCC(O)CCCN MCULE-5150508895 [0,2,0,0,0,0|2,0,0]=4 2752 B7R0.3 CCC(O)CCCO MCULE-1099760826 [0,2,0,0,0,0|1,0,0]=3 2753 B7R0.3 CCC(O)CCOC MCULE-1245099360 [0,2,0,0,0,0|1,0,0]=3 2754 B7R0.3 CCC=CC(C)CC MCULE-8910467842 [0,2,0,0,0,0|2,0,0]=4 2755 B7R0.3 CCCC/C(=N/O)/N MCULE-2186271962 [0,2,0,0,0,0|1,0,1]=4 2756 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [0,2,0,0,0,0|2,0,0]=4 2757 B7R0.3 CCCCC(=N)OC MCULE-3917139857 [0,2,0,0,0,0|1,0,1]=4 2758 B7R0.3 CCCCC(=N)OC MCULE-8394549097 [0,2,0,0,0,0|1,0,1]=4 2759 B7R0.3 CCCCC(=NO)C MCULE-8239265636 [0,2,0,0,0,0|1,0,1]=4 2760 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,2,0,0,0,0|2,0,0]=4 2761 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,2,0,0,0,0|2,0,0]=4 2762 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,2,0,0,0,0|2,0,0]=4 2763 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [0,2,0,0,0,0|1,0,1]=4 2764 B7R0.3 CCCCC(Br)CBr MCULE-9142273359 [0,2,0,0,0,0|2,0,0]=4 2765 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [0,2,0,0,0,0|2,0,0]=4 2766 B7R0.3 CCCCC(C)CC MCULE-9471981954 [0,2,0,0,0,0|2,0,0]=4 2767 B7R0.3 CCCCC(C)NC MCULE-7492621121 [0,2,0,0,0,0|2,0,0]=4 2768 B7R0.3 CCCCC(Cl)C#N MCULE-3338809987 [0,2,0,0,0,0|2,0,0]=4 2769 B7R0.3 CCCCC(Cl)C=O MCULE-7474969991 [0,2,0,0,0,0|1,0,1]=4 2770 B7R0.3 CCCCC(Cl)CCl MCULE-6681580076 [0,2,0,0,0,0|2,0,0]=4 2771 B7R0.3 CCCCC(N)CC MCULE-1353863738 [0,2,0,0,0,0|2,0,0]=4 2772 B7R0.3 CCCCC(N)CC MCULE-9870475040 [0,2,0,0,0,0|2,0,0]=4 2773 B7R0.3 CCCCC(N)CN MCULE-2038464943 [0,2,0,0,0,0|2,0,0]=4 2774 B7R0.3 CCCCC(N)CO MCULE-1874423109 [0,2,0,0,0,0|1,0,0]=3 2775 B7R0.3 CCCCC(N)CO MCULE-2041767659 [0,2,0,0,0,0|1,0,0]=3 2776 B7R0.3 CCCCC(N)CO MCULE-4533575851 [0,2,0,0,0,0|1,0,0]=3 2777 B7R0.3 CCCCC(N)CO MCULE-7141990411 [0,2,0,0,0,0|1,0,0]=3 2778 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [0,2,0,0,0,0|1,0,0]=3 2779 B7R0.3 CCCCC(O)CC MCULE-3912386534 [0,2,0,0,0,0|1,0,0]=3 2780 B7R0.3 CCCCC(O)CN MCULE-1383380728 [0,2,0,0,0,0|1,0,0]=3 2781 B7R0.3 CCCCC(O)CO MCULE-6903923961 [0,2,0,0,0,0|1,0,0]=3 2782 B7R0.3 CCCCN(C)CC MCULE-7723007145 [0,2,0,0,0,0|2,0,0]=4 2783 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [0,2,0,0,0,0|1,0,0]=3 2784 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [0,2,0,0,0,0|1,0,0]=3 2785 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [0,2,0,0,0,0|1,0,0]=3 2786 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [0,2,0,0,0,0|1,0,0]=3 2787 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [0,2,0,0,0,0|1,0,1]=4 2788 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [0,2,0,0,0,0|1,0,0]=3 2789 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [0,2,0,0,0,0|1,0,0]=3 2790 B7R0.3 CCCNC(C)CC MCULE-8533643430 [0,2,0,0,0,0|2,0,0]=4 2791 B7R0.3 CCCNC(C)CO MCULE-6575712324 [0,2,0,0,0,0|1,0,0]=3 2792 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [0,2,0,0,0,0|1,0,1]=4 2793 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [0,2,0,0,0,0|1,0,0]=3 2794 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [0,2,0,0,0,0|1,0,1]=4 2795 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [0,2,0,0,0,0|1,0,1]=4 2796 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [0,2,0,0,0,0|1,0,1]=4 2797 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [0,2,0,0,0,0|0,1,1]=4 2798 B7R0.3 CCCOC(=O)OC MCULE-7254829881 [0,2,0,0,0,0|1,0,1]=4 2799 B7R0.3 CCCOC(C)CN MCULE-2816840734 [0,2,0,0,0,0|1,0,0]=3 2800 B7R0.3 CCCOC(C)CN MCULE-6461157704 [0,2,0,0,0,0|1,0,0]=3 2801 B7R0.3 CCN(C)CCC#N MCULE-5796060585 [0,2,0,0,0,0|2,0,0]=4 2802 B7R0.3 CCN(C)CCCCl MCULE-3619674048 [0,2,0,0,0,0|2,0,0]=4 2803 B7R0.3 CCN(C)CCCCl MCULE-3845564178 [0,2,0,0,0,0|2,0,0]=4 2804 B7R0.3 CCN(C)CCCN MCULE-2231565296 [0,2,0,0,0,0|2,0,0]=4 2805 B7R0.3 CCN(C)CCCO MCULE-9090885474 [0,2,0,0,0,0|1,0,0]=3 2806 B7R0.3 CCN(C)CCNC MCULE-3001815120 [0,2,0,0,0,0|2,0,0]=4 2807 B7R0.3 CCNCC(=O)OC MCULE-7988488004 [0,2,0,0,0,0|1,0,1]=4 2808 B7R0.3 CCNCC(=O)OC MCULE-9483901468 [0,2,0,0,0,0|1,0,1]=4 2809 B7R0.3 CCNCC(C)C#N MCULE-5920854475 [0,2,0,0,0,0|2,0,0]=4 2810 B7R0.3 CCNCC(C)CC MCULE-8768620428 [0,2,0,0,0,0|2,0,0]=4 2811 B7R0.3 CCNCC(C)CC MCULE-9491990692 [0,2,0,0,0,0|2,0,0]=4 2812 B7R0.3 CCNCC(C)OC MCULE-9115511555 [0,2,0,0,0,0|1,0,0]=3 2813 B7R0.3 CCNCC(N)NC MCULE-1380874674 [0,2,0,0,0,0|2,0,0]=4 2814 B7R0.3 CCNCC(O)CC MCULE-9820144398 [0,2,0,0,0,0|1,0,0]=3 2815 B7R0.3 CCOCC(=O)CCl MCULE-3495077500 [0,2,0,0,0,0|1,0,0]=3 2816 B7R0.3 CCOCC(=O)NN MCULE-1157330147 [0,2,0,0,0,0|0,0,2]=4 2817 B7R0.3 CCOCC(=O)NN MCULE-3371253482 [0,2,0,0,0,0|0,0,2]=4 2818 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [0,2,0,0,0,0|0,0,1]=3 2819 B7R0.3 CCOCC(C)CO MCULE-6831759423 [0,2,0,0,0,0|0,0,0]=2 2820 B7R0.3 CCOCC(N)CC MCULE-2793834769 [0,2,0,0,0,0|1,0,0]=3 2821 B7R0.3 CCOCC(N)CC MCULE-5142543434 [0,2,0,0,0,0|1,0,0]=3 2822 B7R0.3 CCOCC(N)CO MCULE-8546500751 [0,2,0,0,0,0|0,0,0]=2 2823 B7R0.3 CCOCC(O)CCl MCULE-5119359541 [0,2,0,0,0,0|0,0,0]=2 2824 B7R0.3 CCOCC(O)CN MCULE-2355759727 [0,2,0,0,0,0|0,0,0]=2 2825 B7R0.3 CCOCC(O)CO MCULE-2728952355 [0,2,0,0,0,0|0,0,0]=2 2826 B7R0.3 CCONC(=O)CN MCULE-8014418978 [0,2,0,0,0,0|1,0,1]=4 2827 B7R0.3 CCONC(=O)CN MCULE-9229677559 [0,2,0,0,0,0|1,0,1]=4 2828 B7R0.3 CCSCC(=O)OC MCULE-2538182357 [0,2,0,0,0,0|0,1,1]=4 2829 B7R0.3 CCSCC(C)NC MCULE-6245105657 [0,2,0,0,0,0|1,1,0]=4 2830 B7R0.3 CCSCC(C)NN MCULE-5847763411 [0,2,0,0,0,0|1,1,0]=4 2831 B7R0.3 CC[C@H](C)CCCO MCULE-1760153718 [0,2,0,0,0,0|1,0,0]=3 2832 B7R0.3 CC[C@H](C)CCCO MCULE-3488695651 [0,2,0,0,0,0|1,0,0]=3 2833 B7R0.3 CNC(=O)CCCO MCULE-2592655912 [0,2,0,0,0,0|1,0,1]=4 2834 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [0,2,0,0,0,0|2,0,0]=4 2835 B7R0.3 CNC(=O)NCCO MCULE-7936045962 [0,2,0,0,0,0|1,0,1]=4 2836 B7R0.3 CNC(=O)OCCCl MCULE-9946450406 [0,2,0,0,0,0|1,0,1]=4 2837 B7R0.3 CNC(=O)OCCO MCULE-7181085118 [0,2,0,0,0,0|0,0,1]=3 2838 B7R0.3 CNOCC(=O)OC MCULE-1491246414 [0,2,0,0,0,0|1,0,1]=4 2839 B7R0.3 CNOCC(=O)OC MCULE-2119135006 [0,2,0,0,0,0|1,0,1]=4 2840 B7R0.3 COC(=O)CCCO MCULE-6149839873 [0,2,0,0,0,0|1,0,1]=4 2841 B7R0.3 COC(=O)NCCO MCULE-7141835204 [0,2,0,0,0,0|1,0,1]=4 2842 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,2,0,0,0,0|2,0,0]=4 2843 B7R0.3 COCCC(=O)OC MCULE-5918489580 [0,2,0,0,0,0|2,0,0]=4 2844 B7R0.3 COCCC(C)CN MCULE-7288397543 [0,2,0,0,0,0|2,0,0]=4 2845 B7R0.3 COCCC(N)CO MCULE-9758817920 [0,2,0,0,0,0|1,0,0]=3 2846 B7R0.3 COCOC(C)CO MCULE-5033492685 [0,2,0,0,0,0|0,0,0]=2 2847 B7R0.3 COCO[C@@H](C)CO MCULE-2279257941 [0,2,0,0,0,0|0,0,0]=2 2848 B7R0.3 COCO[C@H](C)CO MCULE-6639618074 [0,2,0,0,0,0|0,0,0]=2 2849 B7R0.3 COCO[C@H](C)CO MCULE-9421136678 [0,2,0,0,0,0|0,0,0]=2 2850 B7R0.3 CSCCC(N)CO MCULE-1688371230 [0,2,0,0,0,0|1,0,0]=3 2851 B7R0.3 CSCCC(O)C#N MCULE-3484786988 [0,2,0,0,0,0|2,0,0]=4 2852 B7R0.3 CSCCC(O)CN MCULE-3835830442 [0,2,0,0,0,0|2,0,0]=4 2853 B7R0.3 CSCC[C@@H](N)CO MCULE-2764794918 [0,2,0,0,0,0|1,0,0]=3 2854 B7R0.3 CSCC[C@@H](N)CO MCULE-7120101109 [0,2,0,0,0,0|1,0,0]=3 2855 B7R0.3 CSCC[C@H](N)CN MCULE-6460179286 [0,2,0,0,0,0|2,0,0]=4 2856 B7R0.3 CSCC[C@H](N)CO MCULE-6014525130 [0,2,0,0,0,0|1,0,0]=3 2857 B7R0.3 CSCC[C@H](N)CO MCULE-9216326176 [0,2,0,0,0,0|1,0,0]=3 2858 B7R0.3 C[C@@H](CN)CCCO MCULE-2859776250 [0,2,0,0,0,0|1,0,0]=3 2859 B7R0.3 C[C@@H](CN)CCCO MCULE-3245433953 [0,2,0,0,0,0|1,0,0]=3 2860 B7R0.3 C[C@@H](CN)CCCO MCULE-7698870351 [0,2,0,0,0,0|1,0,0]=3 2861 B7R0.3 C[C@@H](CN)CCCO MCULE-9900676606 [0,2,0,0,0,0|1,0,0]=3 2862 B7R0.3 NCC(=O)NCCO MCULE-3809178129 [0,2,0,0,0,0|1,0,1]=4 2863 B7R0.3 NCC(=O)NCCO MCULE-7057019123 [0,2,0,0,0,0|1,0,1]=4 2864 B7R0.3 NCC(=O)OCCCl MCULE-7924059164 [0,2,0,0,0,0|1,0,1]=4 2865 B7R0.3 NCC(=O)OCCCl MCULE-9260214783 [0,2,0,0,0,0|1,0,1]=4 2866 B7R0.3 NCC(Cl)CCCCl MCULE-1250767606 [0,2,0,0,0,0|2,0,0]=4 2867 B7R0.3 NCC(Cl)CCCCl MCULE-1634382406 [0,2,0,0,0,0|2,0,0]=4 2868 B7R0.3 NNC(=O)OCCO MCULE-9375766063 [0,2,0,0,0,0|1,0,1]=4 2869 B7R0.3 O=C(CCl)NCCO MCULE-2803332455 [0,2,0,0,0,0|1,0,1]=4 2870 B7R0.3 O=C(CCl)OCCCl MCULE-7706105725 [0,2,0,0,0,0|1,0,1]=4 2871 B7R0.3 O=C(CO)NCCO MCULE-8933511918 [0,2,0,0,0,0|1,0,1]=4 2872 B7R0.3 OCCCC(O)CO MCULE-3529953491 [0,2,0,0,0,0|1,0,0]=3 2873 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [0,2,0,0,0,0|1,0,1]=4 2874 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [0,2,0,0,0,0|1,0,1]=4 2875 B7R0.5 CC(=O)N(C)CCO MCULE-4135818139 [0,2,0,0,0,0|1,0,1]=4 2876 B7R0.5 CC(C)C(=O)CCN MCULE-1638964690 [0,2,0,0,0,0|2,0,0]=4 2877 B7R0.5 CC(C)C(=O)CCN MCULE-5188027669 [0,2,0,0,0,0|2,0,0]=4 2878 B7R0.5 CC(C)C(=O)NCO MCULE-4279406951 [0,2,0,0,0,0|2,0,0]=4 2879 B7R0.5 CC(C)C(C)CCO MCULE-9837449555 [0,2,0,0,0,0|1,0,0]=3 2880 B7R0.5 CC(C)C(N)CCO MCULE-4571836019 [0,2,0,0,0,0|1,0,0]=3 2881 B7R0.5 CC(C)C(O)CCCl MCULE-3510291624 [0,2,0,0,0,0|2,0,0]=4 2882 B7R0.5 CC(C)C(O)CCN MCULE-2039463209 [0,2,0,0,0,0|2,0,0]=4 2883 B7R0.5 CC(C)C(O)CCN MCULE-2941304015 [0,2,0,0,0,0|2,0,0]=4 2884 B7R0.5 CC(C)C(O)CCO MCULE-8819967893 [0,2,0,0,0,0|1,0,0]=3 2885 B7R0.5 CC(C)N(C)CCN MCULE-2188283644 [0,2,0,0,0,0|2,0,0]=4 2886 B7R0.5 CC(C)N(C)CCN MCULE-4554178088 [0,2,0,0,0,0|2,0,0]=4 2887 B7R0.5 CC(C)N(C)CCO MCULE-5948661117 [0,2,0,0,0,0|1,0,0]=3 2888 B7R0.5 CC(C)[C@H](N)CCO MCULE-5628923252 [0,2,0,0,0,0|1,0,0]=3 2889 B7R0.5 CC(C)[C@H](O)CCN MCULE-1853419872 [0,2,0,0,0,0|2,0,0]=4 2890 B7R0.5 CC(C)[C@H](O)CCN MCULE-1886424228 [0,2,0,0,0,0|2,0,0]=4 2891 B7R0.5 CC(C)[C@H](O)CCN MCULE-7762475170 [0,2,0,0,0,0|2,0,0]=4 2892 B7R0.5 CC(C)[C@H](O)CCN MCULE-8675177820 [0,2,0,0,0,0|2,0,0]=4 2893 B7R0.5 CC(CCO)N(C)C MCULE-4175956173 [0,2,0,0,0,0|2,0,0]=4 2894 B7R0.5 CCCC(=O)C(C)Br MCULE-8743472868 [0,2,0,0,0,0|2,0,0]=4 2895 B7R0.5 CCCC(=O)C(C)C MCULE-7690543374 [0,2,0,0,0,0|2,0,0]=4 2896 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [0,2,0,0,0,0|1,0,1]=4 2897 B7R0.5 CCCC(Br)C(C)Br MCULE-4740207556 [0,2,0,0,0,0|2,0,0]=4 2898 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [0,2,0,0,0,0|1,0,1]=4 2899 B7R0.5 CCCC(C)C(C)C MCULE-1008931357 [0,2,0,0,0,0|2,0,0]=4 2900 B7R0.5 CCCC(C)C(C)N MCULE-3555650010 [0,2,0,0,0,0|2,0,0]=4 2901 B7R0.5 CCCC(C)C(C)N MCULE-8637319249 [0,2,0,0,0,0|2,0,0]=4 2902 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [0,2,0,0,0,0|1,0,0]=3 2903 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [0,2,0,0,0,0|1,0,1]=4 2904 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [0,2,0,0,0,0|1,0,1]=4 2905 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [0,2,0,0,0,0|1,0,1]=4 2906 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [0,2,0,0,0,0|1,0,1]=4 2907 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [0,2,0,0,0,0|1,0,1]=4 2908 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [0,2,0,0,0,0|1,0,1]=4 2909 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [0,2,0,0,0,0|1,0,1]=4 2910 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [0,2,0,0,0,0|2,0,0]=4 2911 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [0,2,0,0,0,0|1,0,1]=4 2912 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [0,2,0,0,0,0|1,0,1]=4 2913 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [0,2,0,0,0,0|1,0,1]=4 2914 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [0,2,0,0,0,0|1,0,1]=4 2915 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [0,2,0,0,0,0|1,0,1]=4 2916 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [0,2,0,0,0,0|1,0,1]=4 2917 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [0,2,0,0,0,0|1,0,1]=4 2918 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [0,2,0,0,0,0|1,0,1]=4 2919 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [0,2,0,0,0,0|1,0,1]=4 2920 B7R0.5 CCNC(=O)[C@H](C)O MCULE-9098995292 [0,2,0,0,0,0|1,0,1]=4 2921 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [0,2,0,0,0,0|1,0,1]=4 2922 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [0,2,0,0,0,0|1,0,1]=4 2923 B7R0.5 CCNC(C)C(C)C MCULE-4222747158 [0,2,0,0,0,0|2,0,0]=4 2924 B7R0.5 CCNC(C)C(C)C MCULE-4653009965 [0,2,0,0,0,0|2,0,0]=4 2925 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [0,2,0,0,0,0|1,0,1]=4 2926 B7R0.5 CCOC(=N)C(C)C MCULE-3425518673 [0,2,0,0,0,0|1,0,1]=4 2927 B7R0.5 CCOC(=N)C(C)C MCULE-9982777491 [0,2,0,0,0,0|1,0,1]=4 2928 B7R0.5 CCOC(=N)C(C)O MCULE-4906645723 [0,2,0,0,0,0|0,0,1]=3 2929 B7R0.5 CCOC(=N)C(C)O MCULE-6342692176 [0,2,0,0,0,0|0,0,1]=3 2930 B7R0.5 CCOC(=N)C(F)F MCULE-5998423176 [0,2,0,0,0,0|1,0,1]=4 2931 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [0,2,0,0,0,0|0,0,2]=4 2932 B7R0.5 CCOC(=O)C(Br)Br MCULE-8701615311 [0,2,0,0,0,0|1,0,1]=4 2933 B7R0.5 CCOC(=O)C(C)Br MCULE-3184697988 [0,2,0,0,0,0|1,0,1]=4 2934 B7R0.5 CCOC(=O)C(C)C MCULE-7190269066 [0,2,0,0,0,0|1,0,1]=4 2935 B7R0.5 CCOC(=O)C(C)Cl MCULE-8192833024 [0,2,0,0,0,0|1,0,1]=4 2936 B7R0.5 CCOC(=O)C(C)F MCULE-5743308430 [0,2,0,0,0,0|1,0,1]=4 2937 B7R0.5 CCOC(=O)C(C)I MCULE-5895787216 [0,2,0,0,0,0|1,0,1]=4 2938 B7R0.5 CCOC(=O)C(C)N MCULE-1694144423 [0,2,0,0,0,0|1,0,1]=4 2939 B7R0.5 CCOC(=O)C(C)N MCULE-4073874506 [0,2,0,0,0,0|1,0,1]=4 2940 B7R0.5 CCOC(=O)C(C)N MCULE-4082731166 [0,2,0,0,0,0|1,0,1]=4 2941 B7R0.5 CCOC(=O)C(C)N MCULE-5175870607 [0,2,0,0,0,0|1,0,1]=4 2942 B7R0.5 CCOC(=O)C(C)O MCULE-8057202883 [0,2,0,0,0,0|0,0,1]=3 2943 B7R0.5 CCOC(=O)C(C)O MCULE-9679398205 [0,2,0,0,0,0|0,0,1]=3 2944 B7R0.5 CCOC(=O)C(C)S MCULE-7890942953 [0,2,0,0,0,0|0,1,1]=4 2945 B7R0.5 CCOC(=O)C(Cl)Cl MCULE-3838429635 [0,2,0,0,0,0|1,0,1]=4 2946 B7R0.5 CCOC(=O)C(F)Br MCULE-5661791694 [0,2,0,0,0,0|1,0,1]=4 2947 B7R0.5 CCOC(=O)C(F)Cl MCULE-4260692293 [0,2,0,0,0,0|1,0,1]=4 2948 B7R0.5 CCOC(=O)C(F)F MCULE-6388513707 [0,2,0,0,0,0|1,0,1]=4 2949 B7R0.5 CCOC(=O)C(F)I MCULE-4681224874 [0,2,0,0,0,0|1,0,1]=4 2950 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1032359164 [0,2,0,0,0,0|1,0,1]=4 2951 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1087923626 [0,2,0,0,0,0|1,0,1]=4 2952 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-1553164105 [0,2,0,0,0,0|1,0,1]=4 2953 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-2294196196 [0,2,0,0,0,0|1,0,1]=4 2954 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-4613491627 [0,2,0,0,0,0|1,0,1]=4 2955 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-8190900780 [0,2,0,0,0,0|1,0,1]=4 2956 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-3372948910 [0,2,0,0,0,0|0,0,1]=3 2957 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-5795033916 [0,2,0,0,0,0|0,0,1]=3 2958 B7R0.5 CCOC(=O)[C@H](C)F MCULE-3258014155 [0,2,0,0,0,0|1,0,1]=4 2959 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4397919899 [0,2,0,0,0,0|1,0,1]=4 2960 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4404274511 [0,2,0,0,0,0|1,0,1]=4 2961 B7R0.5 CCOC(=O)[C@H](C)N MCULE-7626045082 [0,2,0,0,0,0|1,0,1]=4 2962 B7R0.5 CCOC(=O)[C@H](C)N MCULE-8333235087 [0,2,0,0,0,0|1,0,1]=4 2963 B7R0.5 CCOC(=O)[C@H](C)O MCULE-4333545760 [0,2,0,0,0,0|0,0,1]=3 2964 B7R0.5 CCOC(=O)[C@H](C)O MCULE-8787861948 [0,2,0,0,0,0|0,0,1]=3 2965 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [0,2,0,0,0,0|0,0,1]=3 2966 B7R0.5 CCOC(C)C(=S)N MCULE-2027801148 [0,2,0,0,0,0|0,1,1]=4 2967 B7R0.5 CCOC(Cl)C(C)Cl MCULE-8602425289 [0,2,0,0,0,0|1,0,0]=3 2968 B7R0.5 CCOC(O)C(F)F MCULE-2123177092 [0,2,0,0,0,0|1,0,0]=3 2969 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [0,2,0,0,0,0|0,1,1]=4 2970 B7R0.5 CN(C)C(=O)CCO MCULE-8849440937 [0,2,0,0,0,0|2,0,0]=4 2971 B7R0.5 NC(CCO)C(F)F MCULE-1854847569 [0,2,0,0,0,0|2,0,0]=4 2972 B7R0.7 C#CCC(=O)OCC MCULE-2012473321 [0,2,0,0,0,0|1,0,1]=4 2973 B7R0.7 C#CCN(C)CCO MCULE-8096383167 [0,2,0,0,0,0|1,0,1]=4 2974 B7R0.7 C=C(CCBr)CCBr MCULE-2280580612 [0,2,0,0,0,0|2,0,0]=4 2975 B7R0.7 C=C(CCC)CCO MCULE-1774943854 [0,2,0,0,0,0|1,0,0]=3 2976 B7R0.7 C=C(OCC)OCC MCULE-5191107236 [0,2,0,0,0,0|1,0,1]=4 2977 B7R0.7 C=CCC(=O)OCC MCULE-2006542536 [0,2,0,0,0,0|1,0,1]=4 2978 B7R0.7 C=CCC(O)CCC MCULE-4006607391 [0,2,0,0,0,0|2,0,0]=4 2979 B7R0.7 C=CCN(C)CCO MCULE-5364416545 [0,2,0,0,0,0|1,0,1]=4 2980 B7R0.7 CC(CCBr)CCBr MCULE-4358998001 [0,2,0,0,0,0|2,0,0]=4 2981 B7R0.7 CC(CCN)CCO MCULE-7864092529 [0,2,0,0,0,0|1,0,0]=3 2982 B7R0.7 CC(CCO)CCO MCULE-5426211201 [0,2,0,0,0,0|1,0,0]=3 2983 B7R0.7 CCCC(=N)OCC MCULE-5551107242 [0,2,0,0,0,0|1,0,0]=3 2984 B7R0.7 CCCC(=N)OCC MCULE-7790310067 [0,2,0,0,0,0|1,0,0]=3 2985 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [0,2,0,0,0,0|2,0,0]=4 2986 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [0,2,0,0,0,0|1,0,0]=3 2987 B7R0.7 CCCC(=O)OCCl MCULE-5186069317 [0,2,0,0,0,0|2,0,0]=4 2988 B7R0.7 CCCC(Br)CCBr MCULE-7954993658 [0,2,0,0,0,0|2,0,0]=4 2989 B7R0.7 CCCC(Br)CCC MCULE-4124374663 [0,2,0,0,0,0|2,0,0]=4 2990 B7R0.7 CCCC(C)CCC MCULE-5291190768 [0,2,0,0,0,0|2,0,0]=4 2991 B7R0.7 CCCC(C)CCO MCULE-6887128167 [0,2,0,0,0,0|1,0,0]=3 2992 B7R0.7 CCCC(C)NCC MCULE-3443551812 [0,2,0,0,0,0|2,0,0]=4 2993 B7R0.7 CCCC(C)NCC MCULE-7227087576 [0,2,0,0,0,0|2,0,0]=4 2994 B7R0.7 CCCC(C)OCC MCULE-2678814077 [0,2,0,0,0,0|1,0,0]=3 2995 B7R0.7 CCCC(N)CCC MCULE-1003038397 [0,2,0,0,0,0|2,0,0]=4 2996 B7R0.7 CCCC(N)CCC MCULE-3454953409 [0,2,0,0,0,0|2,0,0]=4 2997 B7R0.7 CCCC(N)CCO MCULE-3641094890 [0,2,0,0,0,0|1,0,0]=3 2998 B7R0.7 CCCC(N)CCO MCULE-5323991138 [0,2,0,0,0,0|1,0,0]=3 2999 B7R0.7 CCCC(N)CCO MCULE-6597027417 [0,2,0,0,0,0|1,0,0]=3 3000 B7R0.7 CCCC(N)CCO MCULE-8093709628 [0,2,0,0,0,0|1,0,0]=3 3001 B7R0.7 CCCC(O)CCC MCULE-1942797307 [0,2,0,0,0,0|2,0,0]=4 3002 B7R0.7 CCCC(O)CCN MCULE-3796998426 [0,2,0,0,0,0|2,0,0]=4 3003 B7R0.7 CCCC(O)CCO MCULE-6957178966 [0,2,0,0,0,0|1,0,0]=3 3004 B7R0.7 CCCC(S)CCC MCULE-4775274873 [0,2,0,0,0,0|2,0,0]=4 3005 B7R0.7 CCCC(S)CCO MCULE-7972451905 [0,2,0,0,0,0|1,0,0]=3 3006 B7R0.7 CCCN(C)CCC MCULE-9743961087 [0,2,0,0,0,0|2,0,0]=4 3007 B7R0.7 CCC[C@@H](N)CCO MCULE-1862127512 [0,2,0,0,0,0|1,0,0]=3 3008 B7R0.7 CCC[C@@H](N)CCO MCULE-3031366486 [0,2,0,0,0,0|1,0,0]=3 3009 B7R0.7 CCC[C@@H](N)CCO MCULE-4433535200 [0,2,0,0,0,0|1,0,0]=3 3010 B7R0.7 CCC[C@@H](N)CCO MCULE-8325506694 [0,2,0,0,0,0|1,0,0]=3 3011 B7R0.7 CCC[C@H](N)CCO MCULE-3164100995 [0,2,0,0,0,0|1,0,0]=3 3012 B7R0.7 CCC[C@H](N)CCO MCULE-3262978007 [0,2,0,0,0,0|1,0,0]=3 3013 B7R0.7 CCC[C@H](N)CCO MCULE-3382311889 [0,2,0,0,0,0|1,0,0]=3 3014 B7R0.7 CCC[C@H](N)CCO MCULE-4865013919 [0,2,0,0,0,0|1,0,0]=3 3015 B7R0.7 CCNC(=O)CCCl MCULE-3246776319 [0,2,0,0,0,0|2,0,0]=4 3016 B7R0.7 CCNC(=O)CCN MCULE-2856252531 [0,2,0,0,0,0|2,0,0]=4 3017 B7R0.7 CCNC(=O)CCN MCULE-3929666209 [0,2,0,0,0,0|2,0,0]=4 3018 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [0,2,0,0,0,0|1,0,0]=3 3019 B7R0.7 CCNC(=O)OCC MCULE-3910060770 [0,2,0,0,0,0|1,0,1]=4 3020 B7R0.7 CCNC(C)CCO MCULE-5904294074 [0,2,0,0,0,0|1,0,0]=3 3021 B7R0.7 CCNC(C)COC MCULE-3519332383 [0,2,0,0,0,0|1,0,0]=3 3022 B7R0.7 CCNC(C)COC MCULE-9226487666 [0,2,0,0,0,0|1,0,0]=3 3023 B7R0.7 CCOC(=N)CC#N MCULE-3997647151 [0,2,0,0,0,0|1,0,1]=4 3024 B7R0.7 CCOC(=N)CC#N MCULE-6574650764 [0,2,0,0,0,0|1,0,1]=4 3025 B7R0.7 CCOC(=N)CCCl MCULE-3462649487 [0,2,0,0,0,0|1,0,0]=3 3026 B7R0.7 CCOC(=N)CCCl MCULE-7130199135 [0,2,0,0,0,0|1,0,0]=3 3027 B7R0.7 CCOC(=N)CCO MCULE-8135932013 [0,2,0,0,0,0|0,0,0]=2 3028 B7R0.7 CCOC(=N)CCO MCULE-9125708150 [0,2,0,0,0,0|0,0,0]=2 3029 B7R0.7 CCOC(=N)COC MCULE-1358920023 [0,2,0,0,0,0|0,0,1]=3 3030 B7R0.7 CCOC(=N)COC MCULE-8494947544 [0,2,0,0,0,0|0,0,1]=3 3031 B7R0.7 CCOC(=O)/C=C/O MCULE-1984925411 [0,2,0,0,0,0|0,0,2]=4 3032 B7R0.7 CCOC(=O)C=CO MCULE-2570791221 [0,2,0,0,0,0|0,0,2]=4 3033 B7R0.7 CCOC(=O)C=NO MCULE-8888029932 [0,2,0,0,0,0|0,0,2]=4 3034 B7R0.7 CCOC(=O)CC#N MCULE-3161671261 [0,2,0,0,0,0|1,0,1]=4 3035 B7R0.7 CCOC(=O)CC=O MCULE-5042552247 [0,2,0,0,0,0|0,0,2]=4 3036 B7R0.7 CCOC(=O)CCBr MCULE-1898467026 [0,2,0,0,0,0|1,0,0]=3 3037 B7R0.7 CCOC(=O)CCCl MCULE-2623656770 [0,2,0,0,0,0|1,0,0]=3 3038 B7R0.7 CCOC(=O)CCI MCULE-9651397551 [0,2,0,0,0,0|1,0,0]=3 3039 B7R0.7 CCOC(=O)CCN MCULE-4383008445 [0,2,0,0,0,0|1,0,0]=3 3040 B7R0.7 CCOC(=O)CCN MCULE-6873709061 [0,2,0,0,0,0|1,0,0]=3 3041 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [0,2,0,0,0,0|0,0,0]=2 3042 B7R0.7 CCOC(=O)CCS MCULE-3955367746 [0,2,0,0,0,0|0,1,0]=3 3043 B7R0.7 CCOC(=O)CNC MCULE-3219895330 [0,2,0,0,0,0|1,0,1]=4 3044 B7R0.7 CCOC(=O)CNC MCULE-6164649520 [0,2,0,0,0,0|1,0,1]=4 3045 B7R0.7 CCOC(=O)CNN MCULE-2832319636 [0,2,0,0,0,0|1,0,1]=4 3046 B7R0.7 CCOC(=O)CNN MCULE-3479623348 [0,2,0,0,0,0|1,0,1]=4 3047 B7R0.7 CCOC(=O)CNN MCULE-5066106273 [0,2,0,0,0,0|1,0,1]=4 3048 B7R0.7 CCOC(=O)COC MCULE-7739678079 [0,2,0,0,0,0|0,0,1]=3 3049 B7R0.7 CCOC(=O)CON MCULE-4924818206 [0,2,0,0,0,0|0,0,1]=3 3050 B7R0.7 CCOC(=O)CSC MCULE-5199209389 [0,2,0,0,0,0|0,1,1]=4 3051 B7R0.7 CCOC(=O)NCCl MCULE-9646468987 [0,2,0,0,0,0|1,0,1]=4 3052 B7R0.7 CCOC(=O)NCO MCULE-1265242244 [0,2,0,0,0,0|0,0,1]=3 3053 B7R0.7 CCOC(=O)NOC MCULE-2256963329 [0,2,0,0,0,0|1,0,1]=4 3054 B7R0.7 CCOC(=O)OCC MCULE-1394890550 [0,2,0,0,0,0|1,0,1]=4 3055 B7R0.7 CCOC(=O)OCCl MCULE-9723292956 [0,2,0,0,0,0|1,0,1]=4 3056 B7R0.7 CCOC(=O)OCI MCULE-7994621582 [0,2,0,0,0,0|1,0,1]=4 3057 B7R0.7 CCOC(=S)SCC MCULE-9637505732 [0,2,0,0,0,0|1,0,1]=4 3058 B7R0.7 CCOC(C)CNC MCULE-9630095723 [0,2,0,0,0,0|1,0,0]=3 3059 B7R0.7 CCOC(C)OCC MCULE-7152410134 [0,2,0,0,0,0|1,0,0]=3 3060 B7R0.7 CCOP(C)OCC MCULE-2299160311 [0,2,0,0,0,0|2,0,0]=4 3061 B7R0.7 CCOP(Cl)OCC MCULE-5522995801 [0,2,0,0,0,0|2,0,0]=4 3062 B7R0.7 CCOS(=O)OCC MCULE-6252684995 [0,2,0,0,0,0|2,0,0]=4 3063 B7R0.7 CCSC(C)CC=O MCULE-8200772170 [0,2,0,0,0,0|0,1,1]=4 3064 B7R0.7 CN(CCCl)CCCl MCULE-6341452542 [0,2,0,0,0,0|2,0,0]=4 3065 B7R0.7 CN(CCCl)CCCl MCULE-9007971316 [0,2,0,0,0,0|2,0,0]=4 3066 B7R0.7 CN(CCN)CCN MCULE-2144550137 [0,2,0,0,0,0|2,0,0]=4 3067 B7R0.7 CN(CCN)CCO MCULE-2960427748 [0,2,0,0,0,0|1,0,0]=3 3068 B7R0.7 CN(CCO)CCO MCULE-3967840948 [0,2,0,0,0,0|1,0,0]=3 3069 B7R0.7 CN(CCO)CCO MCULE-6878116085 [0,2,0,0,0,0|1,0,0]=3 3070 B7R0.7 CNCC(O)COC MCULE-8497493216 [0,2,0,0,0,0|2,0,0]=4 3071 B7R0.7 COCC(Br)COC MCULE-8590528928 [0,2,0,0,0,0|2,0,0]=4 3072 B7R0.7 COCC(C)CCO MCULE-6812981556 [0,2,0,0,0,0|1,0,0]=3 3073 B7R0.7 COCC(Cl)COC MCULE-1871071718 [0,2,0,0,0,0|2,0,0]=4 3074 B7R0.7 COCC(N)CCO MCULE-2569422233 [0,2,0,0,0,0|1,0,0]=3 3075 B7R0.7 COCC(N)COC MCULE-3531117264 [0,2,0,0,0,0|2,0,0]=4 3076 B7R0.7 COCC(N)COC MCULE-3609597955 [0,2,0,0,0,0|2,0,0]=4 3077 B7R0.7 COCC(O)CCN MCULE-9524454931 [0,2,0,0,0,0|2,0,0]=4 3078 B7R0.7 COCC(O)COC MCULE-5364514636 [0,2,0,0,0,0|2,0,0]=4 3079 B7R0.7 COCC(O)CON MCULE-3159534337 [0,2,0,0,0,0|2,0,0]=4 3080 B7R0.7 CSCC(N)CCO MCULE-2899374338 [0,2,0,0,0,0|1,0,0]=3 3081 B7R0.7 O=C(CCBr)CCBr MCULE-4794296091 [0,2,0,0,0,0|2,0,0]=4 3082 B7R0.7 O=C(CCCl)CCCl MCULE-1408529874 [0,2,0,0,0,0|2,0,0]=4 3083 B7R0.7 O=C(CCO)CCO MCULE-8765223516 [0,2,0,0,0,0|1,0,0]=3 3084 B7R0.7 O=S(CCO)CCO MCULE-3068452870 [0,2,0,0,0,0|0,1,0]=3 3085 B7R0.7 OCCC(O)CCO MCULE-1162803524 [0,2,0,0,0,0|1,0,0]=3 3086 B7R0.7 P(=O)(OCC)OCC MCULE-8519301551 [0,2,0,0,0,0|2,0,0]=4 3087 B7R0.7 P(=S)(OCC)OCC MCULE-9585241913 [0,2,0,0,0,0|2,0,0]=4 3088 B7R0.10 CC(CN)C(N)CO MCULE-1520376315 [0,2,0,0,0,0|2,0,0]=4 3089 B7R0.10 CC(CN)[C@H](N)CO MCULE-9250442888 [0,2,0,0,0,0|2,0,0]=4 3090 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [0,2,0,0,0,0|2,0,0]=4 3091 B7R0.10 CCC(C)C(C)CC MCULE-8164178184 [0,2,0,0,0,0|2,0,0]=4 3092 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [0,2,0,0,0,0|1,0,0]=3 3093 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [0,2,0,0,0,0|1,0,0]=3 3094 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [0,2,0,0,0,0|2,0,0]=4 3095 B7R0.10 CCC(C)C(O)CN MCULE-1941564207 [0,2,0,0,0,0|2,0,0]=4 3096 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [0,2,0,0,0,0|1,0,0]=3 3097 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [0,2,0,0,0,0|2,0,0]=4 3098 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [0,2,0,0,0,0|1,0,0]=3 3099 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [0,2,0,0,0,0|1,0,0]=3 3100 B7R0.10 CCC(S)C(C)CO MCULE-1500370684 [0,2,0,0,0,0|1,0,0]=3 3101 B7R0.10 CCN(C)C(C)CO MCULE-3647031998 [0,2,0,0,0,0|1,0,0]=3 3102 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [0,2,0,0,0,0|1,0,0]=3 3103 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [0,2,0,0,0,0|1,0,0]=3 3104 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [0,2,0,0,0,0|1,0,0]=3 3105 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-3409941550 [0,2,0,0,0,0|2,0,0]=4 3106 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-9750756690 [0,2,0,0,0,0|2,0,0]=4 3107 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [0,2,0,0,0,0|1,0,0]=3 3108 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [0,2,0,0,0,0|1,0,0]=3 3109 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [0,2,0,0,0,0|1,0,0]=3 3110 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [0,2,0,0,0,0|1,0,0]=3 3111 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [0,2,0,0,0,0|1,0,0]=3 3112 B7R0.10 CNC(=O)C(N)CO MCULE-1507161216 [0,2,0,0,0,0|2,0,0]=4 3113 B7R0.10 COC(=O)C(Br)CO MCULE-1678765423 [0,2,0,0,0,0|2,0,0]=4 3114 B7R0.10 COC(=O)C(Br)CO MCULE-8437488397 [0,2,0,0,0,0|2,0,0]=4 3115 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [0,2,0,0,0,0|2,0,0]=4 3116 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [0,2,0,0,0,0|2,0,0]=4 3117 B7R0.10 COC(=O)C(Cl)CO MCULE-9496750776 [0,2,0,0,0,0|2,0,0]=4 3118 B7R0.10 COC(=O)C(F)CO MCULE-2188518229 [0,2,0,0,0,0|2,0,0]=4 3119 B7R0.10 COC(=O)C(N)CO MCULE-1874204534 [0,2,0,0,0,0|2,0,0]=4 3120 B7R0.10 COC(=O)C(N)CO MCULE-1907797317 [0,2,0,0,0,0|2,0,0]=4 3121 B7R0.10 COC(=O)C(N)CO MCULE-3851022091 [0,2,0,0,0,0|2,0,0]=4 3122 B7R0.10 COC(=O)C(N)CO MCULE-9875856930 [0,2,0,0,0,0|2,0,0]=4 3123 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [0,2,0,0,0,0|2,0,0]=4 3124 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [0,2,0,0,0,0|2,0,0]=4 3125 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8075978888 [0,2,0,0,0,0|2,0,0]=4 3126 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8903256620 [0,2,0,0,0,0|2,0,0]=4 3127 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [0,2,0,0,0,0|2,0,0]=4 3128 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [0,2,0,0,0,0|2,0,0]=4 3129 B7R0.10 COC(=O)[C@@H](N)CO MCULE-2171593224 [0,2,0,0,0,0|2,0,0]=4 3130 B7R0.10 COC(=O)[C@@H](N)CO MCULE-3393088985 [0,2,0,0,0,0|2,0,0]=4 3131 B7R0.10 COC(=O)[C@@H](N)CO MCULE-5476910845 [0,2,0,0,0,0|2,0,0]=4 3132 B7R0.10 COC(=O)[C@@H](N)CO MCULE-9984439264 [0,2,0,0,0,0|2,0,0]=4 3133 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [0,2,0,0,0,0|2,0,0]=4 3134 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [0,2,0,0,0,0|2,0,0]=4 3135 B7R0.10 COC(=O)[C@H](Br)CO MCULE-8230787734 [0,2,0,0,0,0|2,0,0]=4 3136 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [0,2,0,0,0,0|2,0,0]=4 3137 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [0,2,0,0,0,0|2,0,0]=4 3138 B7R0.10 COC(=O)[C@H](N)CO MCULE-4463451892 [0,2,0,0,0,0|2,0,0]=4 3139 B7R0.10 COC(=O)[C@H](N)CO MCULE-5622938569 [0,2,0,0,0,0|2,0,0]=4 3140 B7R0.10 COC(=O)[C@H](N)CO MCULE-6021580541 [0,2,0,0,0,0|2,0,0]=4 3141 B7R0.10 COC(=O)[C@H](N)CO MCULE-8237708167 [0,2,0,0,0,0|2,0,0]=4 3142 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [0,2,0,0,0,0|2,0,0]=4 3143 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [0,2,0,0,0,0|2,0,0]=4 3144 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [0,2,0,0,0,0|2,0,0]=4 3145 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [0,2,0,0,0,0|2,0,0]=4 3146 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [0,2,0,0,0,0|2,0,0]=4 3147 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [0,2,0,0,0,0|2,0,0]=4 3148 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [0,2,0,0,0,0|2,0,0]=4 3149 B7R0.10 OCC(Br)C(Br)CO MCULE-4593943249 [0,2,0,0,0,0|2,0,0]=4 3150 B7R0.10 OCC(O)C(O)CO MCULE-9009953851 [0,2,0,0,0,0|2,0,0]=4 3151 B7R0.10 OC[C@@H](Br)[C@H](Br)CO MCULE-7293448690 [0,2,0,0,0,0|2,0,0]=4 3152 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-1593828237 [0,2,0,0,0,0|2,0,0]=4 3153 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-7577661973 [0,2,0,0,0,0|2,0,0]=4 3154 B7R0.10 OC[C@@H](O)[C@H](S)CS MCULE-1423721945 [0,2,0,0,0,0|2,0,0]=4 3155 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-7306394407 [0,2,0,0,0,0|2,0,0]=4 3156 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-8013265935 [0,2,0,0,0,0|2,0,0]=4 3157 B7R0.10 OC[C@H](O)[C@H](O)CO MCULE-6886999157 [0,2,0,0,0,0|2,0,0]=4 3158 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [0,2,0,0,0,0|1,0,0]=3 3159 B7R0.11 CC(C)(CN)CCO MCULE-8453542373 [0,2,0,0,0,0|2,0,0]=4 3160 B7R0.11 CC(C)(CO)CCN MCULE-5221703852 [0,2,0,0,0,0|2,0,0]=4 3161 B7R0.11 CC(C)(CO)CCN MCULE-7380535368 [0,2,0,0,0,0|2,0,0]=4 3162 B7R0.11 CC(C)(CO)CCO MCULE-1756560398 [0,2,0,0,0,0|2,0,0]=4 3163 B7R0.11 CC(N)(CO)CCF MCULE-5569472665 [0,2,0,0,0,0|2,0,0]=4 3164 B7R0.11 CC(O)(CO)CCO MCULE-4148316300 [0,2,0,0,0,0|2,0,0]=4 3165 B7R0.11 CCC(C)(C)CCBr MCULE-8754627573 [0,2,0,0,0,0|2,0,0]=4 3166 B7R0.11 CCC(C)(C)CCCl MCULE-2699346020 [0,2,0,0,0,0|2,0,0]=4 3167 B7R0.11 CCC(C)(C)CCN MCULE-3224833531 [0,2,0,0,0,0|2,0,0]=4 3168 B7R0.11 CCC(C)(C)CCN MCULE-6016829915 [0,2,0,0,0,0|2,0,0]=4 3169 B7R0.11 CCC(C)(C)CCO MCULE-5248034600 [0,2,0,0,0,0|1,0,0]=3 3170 B7R0.11 CCC(C)(N)CCO MCULE-7673513204 [0,2,0,0,0,0|1,0,0]=3 3171 B7R0.11 CCC(C)(O)CCO MCULE-6173398477 [0,2,0,0,0,0|1,0,0]=3 3172 B7R0.11 CCC(F)(F)CCCl MCULE-4272513464 [0,2,0,0,0,0|2,0,0]=4 3173 B7R0.11 CCCC(C)(C)CC MCULE-6673337989 [0,2,0,0,0,0|2,0,0]=4 3174 B7R0.11 CCCC(C)(N)CN MCULE-3215432035 [0,2,0,0,0,0|2,0,0]=4 3175 B7R0.11 CCCC(C)(N)CO MCULE-9180767555 [0,2,0,0,0,0|1,0,0]=3 3176 B7R0.11 CCCC(C)(O)CC MCULE-9155096022 [0,2,0,0,0,0|2,0,0]=4 3177 B7R0.11 CCCC(C)(O)CN MCULE-4716937953 [0,2,0,0,0,0|2,0,0]=4 3178 B7R0.11 CCCC(C)(O)CO MCULE-3737630396 [0,2,0,0,0,0|1,0,0]=3 3179 B7R0.11 CCNC(C)(C)CO MCULE-9120392867 [0,2,0,0,0,0|1,0,0]=3 3180 B7R0.11 CCNC(C)(C)CO MCULE-9465450982 [0,2,0,0,0,0|1,0,0]=3 3181 B7R0.11 CCOC(C)(C)C=O MCULE-7101941149 [0,2,0,0,0,0|0,0,2]=4 3182 B7R0.11 CCOC(C)(C)CC MCULE-6659357523 [0,2,0,0,0,0|1,0,0]=3 3183 B7R0.11 CCOC(C)(C)CN MCULE-5951578625 [0,2,0,0,0,0|1,0,0]=3 3184 B7R0.11 CCOC(C)(C)CN MCULE-9391246326 [0,2,0,0,0,0|1,0,0]=3 3185 B7R0.11 CCOC(C)(C)CO MCULE-6294474255 [0,2,0,0,0,0|0,0,0]=2 3186 B7R0.11 CCOC(F)(F)CN MCULE-4735040149 [0,2,0,0,0,0|1,0,0]=3 3187 B7R0.11 CCOC(F)(F)CN MCULE-4940531700 [0,2,0,0,0,0|1,0,0]=3 3188 B7R0.11 CCOS(=O)(=O)CC MCULE-8806858417 [0,2,0,0,0,0|2,0,0]=4 3189 B7R0.11 CCO[C@](C)(O)CO MCULE-2547633573 [0,2,0,0,0,0|0,0,0]=2 3190 B7R0.11 CCO[Si](C)(C)CCl MCULE-4646635289 [0,2,0,0,0,0|1,1,0]=4 3191 B7R0.11 CCS(=O)(=O)CCBr MCULE-3576808746 [0,2,0,0,0,0|1,1,0]=4 3192 B7R0.11 CCS(=O)(=O)CCCl MCULE-4470053655 [0,2,0,0,0,0|1,1,0]=4 3193 B7R0.11 CCS(=O)(=O)CCN MCULE-6944259667 [0,2,0,0,0,0|1,1,0]=4 3194 B7R0.11 CCS(=O)(=O)CCN MCULE-8804123313 [0,2,0,0,0,0|1,1,0]=4 3195 B7R0.11 CCS(=O)(=O)CCO MCULE-1810929722 [0,2,0,0,0,0|0,1,0]=3 3196 B7R0.11 CNC(C)(C)CCO MCULE-4689746373 [0,2,0,0,0,0|2,0,0]=4 3197 B7R0.11 CNCC(C)(C)CO MCULE-1912751262 [0,2,0,0,0,0|2,0,0]=4 3198 B7R0.11 CNCC(F)(F)CO MCULE-2629238823 [0,2,0,0,0,0|2,0,0]=4 3199 B7R0.11 COC(C)(C)CCO MCULE-4448949329 [0,2,0,0,0,0|2,0,0]=4 3200 B7R0.11 COCC(C)(C)CO MCULE-2985367717 [0,2,0,0,0,0|2,0,0]=4 3201 B7R0.11 COCC(C)(N)CO MCULE-2603485329 [0,2,0,0,0,0|2,0,0]=4 3202 B7R0.11 COCC(C)(N)CO MCULE-3416999559 [0,2,0,0,0,0|2,0,0]=4 3203 B7R0.11 COCC(F)(F)CO MCULE-7603400715 [0,2,0,0,0,0|2,0,0]=4 3204 B7R0.11 CSCC(C)(C)CO MCULE-4089291196 [0,2,0,0,0,0|2,0,0]=4 3205 B7R0.11 C[N+](C)(CF)CCO MCULE-7470515657 [0,2,0,0,0,0|2,0,0]=4 3206 B7R0.11 C[N+](C)(CF)CCO MCULE-8037348431 [0,2,0,0,0,0|2,0,0]=4 3207 B7R0.11 C[N+](C)(CI)CCO MCULE-1028701878 [0,2,0,0,0,0|2,0,0]=4 3208 B7R0.11 C[N+](C)(CI)CCO MCULE-6877151655 [0,2,0,0,0,0|2,0,0]=4 3209 B7R0.11 OCCC(F)(F)CO MCULE-9524877710 [0,2,0,0,0,0|2,0,0]=4 3210 B7R0.12 C#CC(C#N)OCC MCULE-2963911016 [0,2,0,0,0,0|1,0,1]=4 3211 B7R0.12 CCC(CC)CCN MCULE-4512470364 [0,2,0,0,0,0|2,0,0]=4 3212 B7R0.12 CCC(CC)CCO MCULE-1684491793 [0,2,0,0,0,0|1,0,0]=3 3213 B7R0.12 CCC(CN)CCO MCULE-4612619767 [0,2,0,0,0,0|1,0,0]=3 3214 B7R0.12 CCCC(CN)OC MCULE-6456891707 [0,2,0,0,0,0|2,0,0]=4 3215 B7R0.12 CCCC(CO)CO MCULE-2372919180 [0,2,0,0,0,0|1,0,0]=3 3216 B7R0.12 CCCC(CO)OC MCULE-9427398002 [0,2,0,0,0,0|1,0,0]=3 3217 B7R0.12 CCCN(CC)CC MCULE-4397223277 [0,2,0,0,0,0|2,0,0]=4 3218 B7R0.12 CCN(C#N)CCCl MCULE-3895738051 [0,2,0,0,0,0|2,0,0]=4 3219 B7R0.12 CCN(CC)CCBr MCULE-2448981330 [0,2,0,0,0,0|2,0,0]=4 3220 B7R0.12 CCN(CC)CCBr MCULE-3374941681 [0,2,0,0,0,0|2,0,0]=4 3221 B7R0.12 CCN(CC)CCCl MCULE-4632700695 [0,2,0,0,0,0|2,0,0]=4 3222 B7R0.12 CCN(CC)CCCl MCULE-6988022416 [0,2,0,0,0,0|2,0,0]=4 3223 B7R0.12 CCN(CC)CCI MCULE-3511096859 [0,2,0,0,0,0|2,0,0]=4 3224 B7R0.12 CCN(CC)CCI MCULE-3589074025 [0,2,0,0,0,0|2,0,0]=4 3225 B7R0.12 CCN(CC)CCN MCULE-7267533239 [0,2,0,0,0,0|2,0,0]=4 3226 B7R0.12 CCN(CC)CCO MCULE-6638681325 [0,2,0,0,0,0|1,0,0]=3 3227 B7R0.12 CCN(CC)CCO MCULE-8115329454 [0,2,0,0,0,0|1,0,0]=3 3228 B7R0.12 CCN(CC)CCS MCULE-4732438689 [0,2,0,0,0,0|1,1,0]=4 3229 B7R0.12 CCN(CC)CCS MCULE-7883807246 [0,2,0,0,0,0|1,1,0]=4 3230 B7R0.12 CCN(CCO)N=O MCULE-3100234015 [0,2,0,0,0,0|1,0,0]=3 3231 B7R0.12 CCNC(C#N)CC MCULE-4041959325 [0,2,0,0,0,0|2,0,0]=4 3232 B7R0.12 CCNC(C#N)CC MCULE-8502710031 [0,2,0,0,0,0|2,0,0]=4 3233 B7R0.12 CCNC(CC)CC MCULE-2150962345 [0,2,0,0,0,0|2,0,0]=4 3234 B7R0.12 CCNC(CC)CC MCULE-7819167061 [0,2,0,0,0,0|2,0,0]=4 3235 B7R0.12 CCNC(CC)CO MCULE-2240229411 [0,2,0,0,0,0|1,0,0]=3 3236 B7R0.12 CCN[C@@H](CC)CO MCULE-3793090402 [0,2,0,0,0,0|1,0,0]=3 3237 B7R0.12 CCN[C@@H](CC)CO MCULE-7960570694 [0,2,0,0,0,0|1,0,0]=3 3238 B7R0.12 CCOC(C#N)CBr MCULE-9192705646 [0,2,0,0,0,0|1,0,0]=3 3239 B7R0.12 CCOC(CC)CBr MCULE-9805591276 [0,2,0,0,0,0|1,0,0]=3 3240 B7R0.12 CCOC(CC)CN MCULE-3206225209 [0,2,0,0,0,0|1,0,0]=3 3241 B7R0.12 CCOC(CC)CN MCULE-9811140121 [0,2,0,0,0,0|1,0,0]=3 3242 B7R0.12 CCOC(CN)CN MCULE-8474624366 [0,2,0,0,0,0|1,0,0]=3 3243 B7R0.12 CCOC(CO)CBr MCULE-3004663873 [0,2,0,0,0,0|0,0,0]=2 3244 B7R0.12 CCON(CC)CC MCULE-2387326846 [0,2,0,0,0,0|2,0,0]=4 3245 B7R0.12 CCON(CC)CC MCULE-6925822870 [0,2,0,0,0,0|2,0,0]=4 3246 B7R0.12 COC(CO)CCN MCULE-1177905249 [0,2,0,0,0,0|2,0,0]=4 3247 B7R0.12 COCC(CO)OC MCULE-6775038884 [0,2,0,0,0,0|2,0,0]=4 3248 B7R0.12 COC[C@@H](CO)OC MCULE-7098934437 [0,2,0,0,0,0|2,0,0]=4 3249 B7R0.12 NCCC(CO)CO MCULE-7028267284 [0,2,0,0,0,0|2,0,0]=4 3250 B7R0.12 NCCC(CO)CO MCULE-8865812482 [0,2,0,0,0,0|2,0,0]=4 3251 B7R0.12 OCCC(CO)CO MCULE-7198799967 [0,2,0,0,0,0|2,0,0]=4 3252 B7R0.4 C#CCCCC(C)O MCULE-7136902430 [0,2,0,0,0,0|1,0,1]=4 3253 B7R0.4 C#CCCC[C@@H](C)O MCULE-3650631732 [0,2,0,0,0,0|1,0,1]=4 3254 B7R0.4 C#CCOCC(=O)O MCULE-7164718181 [0,2,0,0,0,0|0,0,2]=4 3255 B7R0.4 C#CCOCC(C)O MCULE-9051899250 [0,2,0,0,0,0|0,0,1]=3 3256 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [0,2,0,0,0,0|1,0,1]=4 3257 B7R0.4 C=C(Br)CCCCC MCULE-3049831354 [0,2,0,0,0,0|2,0,0]=4 3258 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [0,2,0,0,0,0|2,0,0]=4 3259 B7R0.4 C=C(Cl)CCCCC MCULE-5074452982 [0,2,0,0,0,0|2,0,0]=4 3260 B7R0.4 C=CCCCC(C)C MCULE-7578384030 [0,2,0,0,0,0|2,0,0]=4 3261 B7R0.4 C=CCCCC(C)N MCULE-4101795283 [0,2,0,0,0,0|2,0,0]=4 3262 B7R0.4 C=CCCCC(C)O MCULE-6692920526 [0,2,0,0,0,0|1,0,1]=4 3263 B7R0.4 C=CCCNC(C)C MCULE-4275849388 [0,2,0,0,0,0|2,0,0]=4 3264 B7R0.4 C=CCCOC(=O)C MCULE-4554969214 [0,2,0,0,0,0|1,0,1]=4 3265 B7R0.4 C=CCOCC(=O)O MCULE-1419435306 [0,2,0,0,0,0|0,0,2]=4 3266 B7R0.4 CC#CCCC(=O)O MCULE-1415388780 [0,2,0,0,0,0|1,0,1]=4 3267 B7R0.4 CC(=C=CCCO)C MCULE-7603464206 [0,2,0,0,0,0|1,0,1]=4 3268 B7R0.4 CC(=CCCCO)C MCULE-5263952692 [0,2,0,0,0,0|1,0,1]=4 3269 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [0,2,0,0,0,0|2,0,0]=4 3270 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [0,2,0,0,0,0|2,0,0]=4 3271 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [0,2,0,0,0,0|1,0,0]=3 3272 B7R0.4 CC(=O)CSCCF MCULE-8129308816 [0,2,0,0,0,0|1,1,0]=4 3273 B7R0.4 CC(=O)NCCCO MCULE-5627003249 [0,2,0,0,0,0|1,0,1]=4 3274 B7R0.4 CC(=O)NCCON MCULE-3703048482 [0,2,0,0,0,0|1,0,1]=4 3275 B7R0.4 CC(=O)OCCCBr MCULE-4735159476 [0,2,0,0,0,0|1,0,1]=4 3276 B7R0.4 CC(=O)OCCCCl MCULE-4801419214 [0,2,0,0,0,0|1,0,1]=4 3277 B7R0.4 CC(=O)OCCCI MCULE-5830086336 [0,2,0,0,0,0|1,0,1]=4 3278 B7R0.4 CC(=O)OCCCO MCULE-1423430948 [0,2,0,0,0,0|0,0,1]=3 3279 B7R0.4 CC(=O)OCCCS MCULE-2576827025 [0,2,0,0,0,0|0,1,1]=4 3280 B7R0.4 CC(=O)SCCCO MCULE-9014625190 [0,2,0,0,0,0|0,1,1]=4 3281 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [0,2,0,0,0,0|1,0,0]=3 3282 B7R0.4 CC(C)CCCC#N MCULE-8851952716 [0,2,0,0,0,0|2,0,0]=4 3283 B7R0.4 CC(C)CCCC=O MCULE-2846844109 [0,2,0,0,0,0|1,0,1]=4 3284 B7R0.4 CC(C)CCCCBr MCULE-9236389539 [0,2,0,0,0,0|2,0,0]=4 3285 B7R0.4 CC(C)CCCCCl MCULE-5223516486 [0,2,0,0,0,0|2,0,0]=4 3286 B7R0.4 CC(C)CCCCN MCULE-3591523204 [0,2,0,0,0,0|2,0,0]=4 3287 B7R0.4 CC(C)CCCCO MCULE-9053698607 [0,2,0,0,0,0|1,0,0]=3 3288 B7R0.4 CC(C)CCCON MCULE-5299845209 [0,2,0,0,0,0|1,0,0]=3 3289 B7R0.4 CC(C)CCCON MCULE-8643496539 [0,2,0,0,0,0|1,0,0]=3 3290 B7R0.4 CC(C)CNCCN MCULE-3059280265 [0,2,0,0,0,0|2,0,0]=4 3291 B7R0.4 CC(C)CNCCO MCULE-3948234461 [0,2,0,0,0,0|1,0,0]=3 3292 B7R0.4 CC(C)CNCCO MCULE-6673201049 [0,2,0,0,0,0|1,0,0]=3 3293 B7R0.4 CC(C)COCCBr MCULE-7232103778 [0,2,0,0,0,0|1,0,0]=3 3294 B7R0.4 CC(C)COCCN MCULE-9238454281 [0,2,0,0,0,0|1,0,0]=3 3295 B7R0.4 CC(C)COCCN MCULE-9987398976 [0,2,0,0,0,0|1,0,0]=3 3296 B7R0.4 CC(C)COCCO MCULE-2997702641 [0,2,0,0,0,0|0,0,0]=2 3297 B7R0.4 CC(C)CSCCCl MCULE-1798266957 [0,2,0,0,0,0|1,1,0]=4 3298 B7R0.4 CC(C)CSCCN MCULE-6100886830 [0,2,0,0,0,0|1,1,0]=4 3299 B7R0.4 CC(C)CSCCN MCULE-8368453687 [0,2,0,0,0,0|1,1,0]=4 3300 B7R0.4 CC(C)CSCCO MCULE-5481216581 [0,2,0,0,0,0|0,1,0]=3 3301 B7R0.4 CC(C)NCCC#N MCULE-4213887159 [0,2,0,0,0,0|2,0,0]=4 3302 B7R0.4 CC(C)NCCC#N MCULE-9871248410 [0,2,0,0,0,0|2,0,0]=4 3303 B7R0.4 CC(C)NCCCN MCULE-2900400569 [0,2,0,0,0,0|2,0,0]=4 3304 B7R0.4 CC(C)NCCCO MCULE-4556994899 [0,2,0,0,0,0|1,0,0]=3 3305 B7R0.4 CC(C)NCCCO MCULE-9550690390 [0,2,0,0,0,0|1,0,0]=3 3306 B7R0.4 CC(C)OCCC#N MCULE-4613636194 [0,2,0,0,0,0|1,0,0]=3 3307 B7R0.4 CC(C)OCCCBr MCULE-6061340501 [0,2,0,0,0,0|1,0,0]=3 3308 B7R0.4 CC(C)OCCCCl MCULE-5339928259 [0,2,0,0,0,0|1,0,0]=3 3309 B7R0.4 CC(C)OCCCN MCULE-6787172017 [0,2,0,0,0,0|1,0,0]=3 3310 B7R0.4 CC(C)OCCCN MCULE-8495001717 [0,2,0,0,0,0|1,0,0]=3 3311 B7R0.4 CC(C)OCCCO MCULE-9280654202 [0,2,0,0,0,0|0,0,0]=2 3312 B7R0.4 CC(C)OCCON MCULE-8218216454 [0,2,0,0,0,0|0,0,0]=2 3313 B7R0.4 CC(C)SCCCN MCULE-6322440113 [0,2,0,0,0,0|1,1,0]=4 3314 B7R0.4 CC(C)SCCCO MCULE-4296249117 [0,2,0,0,0,0|0,1,0]=3 3315 B7R0.4 CC(Cl)CCCCCl MCULE-4829013540 [0,2,0,0,0,0|2,0,0]=4 3316 B7R0.4 CC(Cl)CNCCCl MCULE-2269449058 [0,2,0,0,0,0|2,0,0]=4 3317 B7R0.4 CC(Cl)CNCCCl MCULE-4107266640 [0,2,0,0,0,0|2,0,0]=4 3318 B7R0.4 CC(Cl)COCCCl MCULE-5744839272 [0,2,0,0,0,0|1,0,0]=3 3319 B7R0.4 CC(N)CCCCN MCULE-3497267062 [0,2,0,0,0,0|2,0,0]=4 3320 B7R0.4 CC(N)CCCCN MCULE-9887360104 [0,2,0,0,0,0|2,0,0]=4 3321 B7R0.4 CC(N)CCCCO MCULE-7039935081 [0,2,0,0,0,0|1,0,0]=3 3322 B7R0.4 CC(N)CCCCO MCULE-8167834378 [0,2,0,0,0,0|1,0,0]=3 3323 B7R0.4 CC(O)CCCCO MCULE-3790969400 [0,2,0,0,0,0|1,0,0]=3 3324 B7R0.4 CC(O)CNCCN MCULE-3904214677 [0,2,0,0,0,0|1,0,0]=3 3325 B7R0.4 CC(O)CNCCO MCULE-4873845500 [0,2,0,0,0,0|1,0,0]=3 3326 B7R0.4 CC(O)CSCCO MCULE-8885458360 [0,2,0,0,0,0|0,1,0]=3 3327 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [0,2,0,0,0,0|1,0,1]=4 3328 B7R0.4 CCC#CCC(C)O MCULE-4633396611 [0,2,0,0,0,0|1,0,0]=3 3329 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [0,2,0,0,0,0|1,0,1]=4 3330 B7R0.4 CCC=CCC(C)C MCULE-6798729321 [0,2,0,0,0,0|2,0,0]=4 3331 B7R0.4 CCCC#CC(C)O MCULE-4333844811 [0,2,0,0,0,0|1,0,1]=4 3332 B7R0.4 CCCC=CC(C)C MCULE-6546702510 [0,2,0,0,0,0|2,0,0]=4 3333 B7R0.4 CCCCCB(O)O MCULE-3441747739 [0,2,0,0,0,0|1,0,0]=3 3334 B7R0.4 CCCCCC(=N)N MCULE-4874167268 [0,2,0,0,0,0|2,0,0]=4 3335 B7R0.4 CCCCCC(=N)N MCULE-6942690708 [0,2,0,0,0,0|2,0,0]=4 3336 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [0,2,0,0,0,0|1,0,1]=4 3337 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [0,2,0,0,0,0|1,0,1]=4 3338 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [0,2,0,0,0,0|1,0,1]=4 3339 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [0,2,0,0,0,0|1,0,0]=3 3340 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [0,2,0,0,0,0|1,0,1]=4 3341 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [0,2,0,0,0,0|1,0,1]=4 3342 B7R0.4 CCCCCC(=S)N MCULE-7633089850 [0,2,0,0,0,0|1,1,0]=4 3343 B7R0.4 CCCCCC(C)Br MCULE-4688847972 [0,2,0,0,0,0|2,0,0]=4 3344 B7R0.4 CCCCCC(C)C MCULE-9815158757 [0,2,0,0,0,0|2,0,0]=4 3345 B7R0.4 CCCCCC(C)Cl MCULE-1461261404 [0,2,0,0,0,0|2,0,0]=4 3346 B7R0.4 CCCCCC(C)N MCULE-1307982487 [0,2,0,0,0,0|2,0,0]=4 3347 B7R0.4 CCCCCC(C)N MCULE-8625441795 [0,2,0,0,0,0|2,0,0]=4 3348 B7R0.4 CCCCCC(C)N MCULE-9791654909 [0,2,0,0,0,0|2,0,0]=4 3349 B7R0.4 CCCCCC(C)O MCULE-2463855771 [0,2,0,0,0,0|1,0,0]=3 3350 B7R0.4 CCCCCC(C)S MCULE-3173115736 [0,2,0,0,0,0|1,1,0]=4 3351 B7R0.4 CCCCCN(=O)=O MCULE-6853489453 [0,2,0,0,0,0|1,0,1]=4 3352 B7R0.4 CCCCCP(Cl)Cl MCULE-9695212092 [0,2,0,0,0,0|2,0,0]=4 3353 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [0,2,0,0,0,0|2,0,0]=4 3354 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [0,2,0,0,0,0|2,0,0]=4 3355 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [0,2,0,0,0,0|2,0,0]=4 3356 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [0,2,0,0,0,0|1,0,0]=3 3357 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [0,2,0,0,0,0|1,0,0]=3 3358 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [0,2,0,0,0,0|2,0,0]=4 3359 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [0,2,0,0,0,0|2,0,0]=4 3360 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [0,2,0,0,0,0|1,0,0]=3 3361 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [0,2,0,0,0,0|1,0,0]=3 3362 B7R0.4 CCCCNC(C)C MCULE-2695970517 [0,2,0,0,0,0|2,0,0]=4 3363 B7R0.4 CCCCNC(C)C MCULE-9973816117 [0,2,0,0,0,0|2,0,0]=4 3364 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [0,2,0,0,0,0|1,0,1]=4 3365 B7R0.4 CCCCOC(C)C MCULE-1504269570 [0,2,0,0,0,0|1,0,0]=3 3366 B7R0.4 CCCCOC(Cl)Cl MCULE-2958816896 [0,2,0,0,0,0|2,0,0]=4 3367 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [0,2,0,0,0,0|1,0,1]=4 3368 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [0,2,0,0,0,0|1,0,1]=4 3369 B7R0.4 CCCNCC(C)C MCULE-2869656642 [0,2,0,0,0,0|2,0,0]=4 3370 B7R0.4 CCCNCC(C)O MCULE-8110237473 [0,2,0,0,0,0|1,0,0]=3 3371 B7R0.4 CCCNCC(F)F MCULE-5407680209 [0,2,0,0,0,0|2,0,0]=4 3372 B7R0.4 CCCNCC(F)F MCULE-9676670786 [0,2,0,0,0,0|2,0,0]=4 3373 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [0,2,0,0,0,0|0,0,1]=3 3374 B7R0.4 CCCOCC(=S)N MCULE-4681127635 [0,2,0,0,0,0|0,1,1]=4 3375 B7R0.4 CCCOCC(C)O MCULE-9214840563 [0,2,0,0,0,0|0,0,0]=2 3376 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [0,2,0,0,0,0|1,1,0]=4 3377 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [0,2,0,0,0,0|0,1,1]=4 3378 B7R0.4 CCNCCC(=O)N MCULE-4857735433 [0,2,0,0,0,0|1,0,1]=4 3379 B7R0.4 CCNCCC(=O)N MCULE-8238114591 [0,2,0,0,0,0|1,0,1]=4 3380 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [0,2,0,0,0,0|1,0,0]=3 3381 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [0,2,0,0,0,0|1,0,0]=3 3382 B7R0.4 CCNCCN(C)C MCULE-6722045380 [0,2,0,0,0,0|2,0,0]=4 3383 B7R0.4 CCO/C=C/C(=O)O MCULE-6712227034 [0,2,0,0,0,0|0,0,2]=4 3384 B7R0.4 CCO/C=C/C(C)C MCULE-7416901605 [0,2,0,0,0,0|1,0,1]=4 3385 B7R0.4 CCOC=CB(O)O MCULE-6808942248 [0,2,0,0,0,0|0,0,2]=4 3386 B7R0.4 CCOC=CC(=O)O MCULE-4776715351 [0,2,0,0,0,0|0,0,2]=4 3387 B7R0.4 CCOC=CC(C)C MCULE-3218868182 [0,2,0,0,0,0|1,0,1]=4 3388 B7R0.4 CCOCCC(=N)N MCULE-4926091113 [0,2,0,0,0,0|1,0,0]=3 3389 B7R0.4 CCOCCC(=N)N MCULE-8590303415 [0,2,0,0,0,0|1,0,0]=3 3390 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [0,2,0,0,0,0|0,0,1]=3 3391 B7R0.4 CCOCCC(=O)Cl MCULE-8299617790 [0,2,0,0,0,0|0,0,1]=3 3392 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [0,2,0,0,0,0|0,0,0]=2 3393 B7R0.4 CCOCNC(=O)N MCULE-7680870721 [0,2,0,0,0,0|0,0,2]=4 3394 B7R0.4 CCONCC(C)C MCULE-3595879270 [0,2,0,0,0,0|1,0,0]=3 3395 B7R0.4 CCONCC(C)C MCULE-6329996438 [0,2,0,0,0,0|1,0,0]=3 3396 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [0,2,0,0,0,0|0,1,0]=3 3397 B7R0.4 CCSCCC(C)N MCULE-6854502332 [0,2,0,0,0,0|1,1,0]=4 3398 B7R0.4 CN(C)CC#CCO MCULE-9910143603 [0,2,0,0,0,0|1,0,1]=4 3399 B7R0.4 CN(C)CCCCBr MCULE-3700239066 [0,2,0,0,0,0|2,0,0]=4 3400 B7R0.4 CN(C)CCCCBr MCULE-5243977766 [0,2,0,0,0,0|2,0,0]=4 3401 B7R0.4 CN(C)CCCCCl MCULE-5038597183 [0,2,0,0,0,0|2,0,0]=4 3402 B7R0.4 CN(C)CCCCCl MCULE-8885080954 [0,2,0,0,0,0|2,0,0]=4 3403 B7R0.4 CN(C)CCCCN MCULE-4457571368 [0,2,0,0,0,0|2,0,0]=4 3404 B7R0.4 CN(C)CCCCN MCULE-9067239115 [0,2,0,0,0,0|2,0,0]=4 3405 B7R0.4 CN(C)CCCCO MCULE-6973654872 [0,2,0,0,0,0|1,0,0]=3 3406 B7R0.4 CN(C)CCCON MCULE-1245472313 [0,2,0,0,0,0|2,0,0]=4 3407 B7R0.4 CN(C)CCCON MCULE-5946614062 [0,2,0,0,0,0|2,0,0]=4 3408 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [0,2,0,0,0,0|1,0,1]=4 3409 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [0,2,0,0,0,0|1,0,1]=4 3410 B7R0.4 CNCCCC(C)C MCULE-1784678333 [0,2,0,0,0,0|2,0,0]=4 3411 B7R0.4 CNCCNC(C)C MCULE-9007534493 [0,2,0,0,0,0|2,0,0]=4 3412 B7R0.4 CNCCOC(=O)C MCULE-1850077864 [0,2,0,0,0,0|1,0,1]=4 3413 B7R0.4 CNCCOC(=O)C MCULE-7023987942 [0,2,0,0,0,0|1,0,1]=4 3414 B7R0.4 COCCCC(=O)C MCULE-3606369396 [0,2,0,0,0,0|1,0,1]=4 3415 B7R0.4 COCCCC(=O)O MCULE-3165881573 [0,2,0,0,0,0|1,0,1]=4 3416 B7R0.4 COCCCC(C)N MCULE-4298611846 [0,2,0,0,0,0|1,0,0]=3 3417 B7R0.4 COCCCC(C)N MCULE-8139434838 [0,2,0,0,0,0|1,0,0]=3 3418 B7R0.4 COCCCC(C)O MCULE-4190294636 [0,2,0,0,0,0|1,0,0]=3 3419 B7R0.4 COCCNC(=O)C MCULE-2794263612 [0,2,0,0,0,0|1,0,1]=4 3420 B7R0.4 COCCNC(C)C MCULE-2061720092 [0,2,0,0,0,0|1,0,0]=3 3421 B7R0.4 COCCOC(=O)C MCULE-3221264060 [0,2,0,0,0,0|0,0,1]=3 3422 B7R0.4 COCCOC(=O)Cl MCULE-7308809094 [0,2,0,0,0,0|1,0,1]=4 3423 B7R0.4 COCCOC(=O)N MCULE-3401505850 [0,2,0,0,0,0|1,0,1]=4 3424 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [0,2,0,0,0,0|1,0,1]=4 3425 B7R0.4 CSCCOC(=O)C MCULE-3742242959 [0,2,0,0,0,0|0,1,1]=4 3426 B7R0.4 CSSCCC(=O)O MCULE-6571821309 [0,2,0,0,0,0|1,1,0]=4 3427 B7R0.4 FC(F)COCCBr MCULE-5816712150 [0,2,0,0,0,0|1,0,0]=3 3428 B7R0.4 FC(F)COCCCl MCULE-8007431622 [0,2,0,0,0,0|1,0,0]=3 3429 B7R0.4 N#CCOCC(F)F MCULE-8320383341 [0,2,0,0,0,0|1,0,1]=4 3430 B7R0.4 NC(=O)CCCCO MCULE-4820227146 [0,2,0,0,0,0|1,0,1]=4 3431 B7R0.4 NC(=O)COCCCl MCULE-1141300697 [0,2,0,0,0,0|0,0,2]=4 3432 B7R0.4 NC(=O)COCCO MCULE-3158372920 [0,2,0,0,0,0|0,0,1]=3 3433 B7R0.4 NC(=O)CSCCO MCULE-8225407259 [0,2,0,0,0,0|0,1,1]=4 3434 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [0,2,0,0,0,0|1,0,1]=4 3435 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [0,2,0,0,0,0|1,0,1]=4 3436 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [0,2,0,0,0,0|1,0,1]=4 3437 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [0,2,0,0,0,0|1,0,1]=4 3438 B7R0.4 NCCCOC(F)F MCULE-9181708891 [0,2,0,0,0,0|2,0,0]=4 3439 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [0,2,0,0,0,0|1,0,1]=4 3440 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [0,2,0,0,0,0|1,0,1]=4 3441 B7R0.4 NCCOCC(=O)O MCULE-2375694645 [0,2,0,0,0,0|0,0,1]=3 3442 B7R0.4 NCCOCC(=O)O MCULE-5877065986 [0,2,0,0,0,0|0,0,1]=3 3443 B7R0.4 NCCOCC(F)F MCULE-1779124297 [0,2,0,0,0,0|1,0,0]=3 3444 B7R0.4 NCCOCC(F)F MCULE-1970540798 [0,2,0,0,0,0|1,0,0]=3 3445 B7R0.4 NCCSCC(=O)O MCULE-5565800206 [0,2,0,0,0,0|0,1,1]=4 3446 B7R0.4 NCCSCC(=O)O MCULE-8322098978 [0,2,0,0,0,0|0,1,1]=4 3447 B7R0.4 NCCSCC(F)F MCULE-2643130155 [0,2,0,0,0,0|1,1,0]=4 3448 B7R0.4 O=C(Cl)COCCCl MCULE-9707252778 [0,2,0,0,0,0|0,0,2]=4 3449 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [0,2,0,0,0,0|1,0,1]=4 3450 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [0,2,0,0,0,0|1,0,1]=4 3451 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [0,2,0,0,0,0|1,0,1]=4 3452 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [0,2,0,0,0,0|1,0,1]=4 3453 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [0,2,0,0,0,0|1,0,1]=4 3454 B7R0.4 O=C(O)COCCBr MCULE-4593325557 [0,2,0,0,0,0|0,0,1]=3 3455 B7R0.4 O=C(O)COCCCl MCULE-2978816248 [0,2,0,0,0,0|0,0,1]=3 3456 B7R0.4 O=C(O)COCCF MCULE-9820799514 [0,2,0,0,0,0|0,0,1]=3 3457 B7R0.4 O=C(O)COCCO MCULE-8297137880 [0,2,0,0,0,0|0,0,1]=3 3458 B7R0.4 O=C(O)CSCCCl MCULE-5204967583 [0,2,0,0,0,0|0,1,1]=4 3459 B7R0.4 O=C(O)CSCCO MCULE-1062560307 [0,2,0,0,0,0|0,1,1]=4 3460 B7R0.4 O=C([O-])CCCCO MCULE-3836827182 [0,2,0,0,0,0|1,0,1]=4 3461 B7R0.4 O=C([O-])COCCO MCULE-7093344226 [0,2,0,0,0,0|0,0,1]=3 3462 B7R0.4 O=N(=O)CCCCO MCULE-4639070341 [0,2,0,0,0,0|2,0,0]=4 3463 B7R0.4 O=N(=O)OCCCO MCULE-3030828224 [0,2,0,0,0,0|2,0,0]=4 3464 B7R0.4 OB(O)CCCCBr MCULE-3231135677 [0,2,0,0,0,0|2,0,0]=4 3465 B7R0.4 OCCNCC(F)F MCULE-3691382123 [0,2,0,0,0,0|1,0,0]=3 3466 B7R0.4 OCCOCC(F)F MCULE-3170201998 [0,2,0,0,0,0|0,0,0]=2 3467 B7R0.6 C=C(C)CCC(C)O MCULE-5005514248 [0,2,0,0,0,0|1,0,1]=4 3468 B7R0.6 CC(=O)COC(C)C MCULE-4426769810 [0,2,0,0,0,0|0,0,2]=4 3469 B7R0.6 CC(=O)NCC(C)O MCULE-2406798273 [0,2,0,0,0,0|1,0,1]=4 3470 B7R0.6 CC(=O)OCC(=O)O MCULE-6837320824 [0,2,0,0,0,0|0,0,2]=4 3471 B7R0.6 CC(=O)OCC(C)C MCULE-4530584087 [0,2,0,0,0,0|1,0,1]=4 3472 B7R0.6 CC(=O)OCC(C)O MCULE-3660209140 [0,2,0,0,0,0|0,0,1]=3 3473 B7R0.6 CC(=O)OCC(F)F MCULE-9491615455 [0,2,0,0,0,0|1,0,1]=4 3474 B7R0.6 CC(Br)CCC(C)Br MCULE-4511070452 [0,2,0,0,0,0|2,0,0]=4 3475 B7R0.6 CC(C)CCB(O)O MCULE-7387060292 [0,2,0,0,0,0|2,0,0]=4 3476 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [0,2,0,0,0,0|1,0,1]=4 3477 B7R0.6 CC(C)CCC(C)Br MCULE-4005079361 [0,2,0,0,0,0|2,0,0]=4 3478 B7R0.6 CC(C)CCC(C)C MCULE-4093485278 [0,2,0,0,0,0|2,0,0]=4 3479 B7R0.6 CC(C)CCC(C)N MCULE-3038746969 [0,2,0,0,0,0|2,0,0]=4 3480 B7R0.6 CC(C)CCC(C)N MCULE-7972635029 [0,2,0,0,0,0|2,0,0]=4 3481 B7R0.6 CC(C)CCC(C)O MCULE-6292509345 [0,2,0,0,0,0|1,0,0]=3 3482 B7R0.6 CC(C)CNC(C)C MCULE-1556200503 [0,2,0,0,0,0|2,0,0]=4 3483 B7R0.6 CC(C)CNC(C)C MCULE-9703437877 [0,2,0,0,0,0|2,0,0]=4 3484 B7R0.6 CC(C)NCC(=O)O MCULE-4344882030 [0,2,0,0,0,0|1,0,1]=4 3485 B7R0.6 CC(C)NCC(=O)O MCULE-7052227156 [0,2,0,0,0,0|1,0,1]=4 3486 B7R0.6 CC(C)OCC(=O)Cl MCULE-5892054766 [0,2,0,0,0,0|0,0,2]=4 3487 B7R0.6 CC(C)OCC(=O)O MCULE-8295905061 [0,2,0,0,0,0|0,0,1]=3 3488 B7R0.6 CC(C)OCC(=S)N MCULE-8843903229 [0,2,0,0,0,0|0,1,1]=4 3489 B7R0.6 CC(C)OC[C@H](C)O MCULE-2195035455 [0,2,0,0,0,0|0,0,0]=2 3490 B7R0.6 CC(C)SCC(=O)O MCULE-3990750464 [0,2,0,0,0,0|0,1,1]=4 3491 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [0,2,0,0,0,0|1,0,1]=4 3492 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [0,2,0,0,0,0|1,0,1]=4 3493 B7R0.6 CC(N)CCC(F)F MCULE-6444451088 [0,2,0,0,0,0|2,0,0]=4 3494 B7R0.6 CC(N)CCC(F)F MCULE-9287101789 [0,2,0,0,0,0|2,0,0]=4 3495 B7R0.6 CC(N)COC(F)F MCULE-1844819697 [0,2,0,0,0,0|2,0,0]=4 3496 B7R0.6 CC(N)COC(F)F MCULE-9510461424 [0,2,0,0,0,0|2,0,0]=4 3497 B7R0.6 CC(O)C#CC(C)O MCULE-5307271719 [0,2,0,0,0,0|1,0,1]=4 3498 B7R0.6 CC(O)C=CC(C)O MCULE-1362403822 [0,2,0,0,0,0|1,0,1]=4 3499 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [0,2,0,0,0,0|1,0,1]=4 3500 B7R0.6 CC(O)CCC(C)O MCULE-6170497684 [0,2,0,0,0,0|1,0,0]=3 3501 B7R0.6 CC(O)CCN(C)C MCULE-7246080230 [0,2,0,0,0,0|2,0,0]=4 3502 B7R0.6 CC(O)CNC(C)C MCULE-9932831006 [0,2,0,0,0,0|1,0,0]=3 3503 B7R0.6 CC(O)COC(C)C MCULE-3357280817 [0,2,0,0,0,0|0,0,0]=2 3504 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [0,2,0,0,0,0|1,0,1]=4 3505 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [0,2,0,0,0,0|1,0,1]=4 3506 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [0,2,0,0,0,0|1,0,1]=4 3507 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [0,2,0,0,0,0|1,0,1]=4 3508 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [0,2,0,0,0,0|1,0,1]=4 3509 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-3982464496 [0,2,0,0,0,0|1,0,0]=3 3510 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-6083261012 [0,2,0,0,0,0|1,0,0]=3 3511 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-8142548171 [0,2,0,0,0,0|1,0,0]=3 3512 B7R0.6 C[C@@H](O)COC(=O)O MCULE-3794886346 [0,2,0,0,0,0|1,0,1]=4 3513 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [0,2,0,0,0,0|1,0,1]=4 3514 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [0,2,0,0,0,0|1,0,1]=4 3515 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-5867971604 [0,2,0,0,0,0|1,0,0]=3 3516 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-7024859164 [0,2,0,0,0,0|1,0,0]=3 3517 B7R0.6 O=C(O)COC(F)F MCULE-1418551422 [0,2,0,0,0,0|1,0,1]=4 3518 B7R0.8 C#CCOC(C)(C)C MCULE-5311939611 [0,2,0,0,0,0|1,0,1]=4 3519 B7R0.8 CC(C)(C)C#CCO MCULE-3181103976 [0,2,0,0,0,0|1,0,1]=4 3520 B7R0.8 CC(C)(C)CCCBr MCULE-4957327319 [0,2,0,0,0,0|2,0,0]=4 3521 B7R0.8 CC(C)(C)CCCCl MCULE-2639997289 [0,2,0,0,0,0|2,0,0]=4 3522 B7R0.8 CC(C)(C)CCCN MCULE-4819398612 [0,2,0,0,0,0|2,0,0]=4 3523 B7R0.8 CC(C)(C)CCCN MCULE-8532835162 [0,2,0,0,0,0|2,0,0]=4 3524 B7R0.8 CC(C)(C)CCCO MCULE-6612017649 [0,2,0,0,0,0|1,0,0]=3 3525 B7R0.8 CC(C)(C)NCCCl MCULE-1270430543 [0,2,0,0,0,0|2,0,0]=4 3526 B7R0.8 CC(C)(C)NCCCl MCULE-9312220001 [0,2,0,0,0,0|2,0,0]=4 3527 B7R0.8 CC(C)(C)NCCN MCULE-2383743935 [0,2,0,0,0,0|2,0,0]=4 3528 B7R0.8 CC(C)(C)NCCN MCULE-6850852701 [0,2,0,0,0,0|2,0,0]=4 3529 B7R0.8 CC(C)(C)NCCO MCULE-4847202538 [0,2,0,0,0,0|1,0,0]=3 3530 B7R0.8 CC(C)(C)OCC#N MCULE-7916487063 [0,2,0,0,0,0|1,0,1]=4 3531 B7R0.8 CC(C)(C)OCCBr MCULE-8312810817 [0,2,0,0,0,0|1,0,0]=3 3532 B7R0.8 CC(C)(C)OCCI MCULE-2149225094 [0,2,0,0,0,0|1,0,0]=3 3533 B7R0.8 CC(C)(C)OCCN MCULE-8529298799 [0,2,0,0,0,0|1,0,0]=3 3534 B7R0.8 CC(C)(C)OCCN MCULE-9331958272 [0,2,0,0,0,0|1,0,0]=3 3535 B7R0.8 CC(C)(C)OCCO MCULE-7079168773 [0,2,0,0,0,0|0,0,0]=2 3536 B7R0.8 CC(C)(C)SCCBr MCULE-5567761967 [0,2,0,0,0,0|1,1,0]=4 3537 B7R0.8 CC(C)(C)SCCI MCULE-3564451917 [0,2,0,0,0,0|1,1,0]=4 3538 B7R0.8 CC(C)(C)SCCN MCULE-1488861234 [0,2,0,0,0,0|1,1,0]=4 3539 B7R0.8 CC(C)(C)SCCN MCULE-2374733515 [0,2,0,0,0,0|1,1,0]=4 3540 B7R0.8 CC(C)(C)SCCO MCULE-5098402639 [0,2,0,0,0,0|0,1,0]=3 3541 B7R0.8 CC(C)(C)SCCS MCULE-9098945945 [0,2,0,0,0,0|0,2,0]=4 3542 B7R0.8 CC(C)(N)CCCN MCULE-2030762085 [0,2,0,0,0,0|2,0,0]=4 3543 B7R0.8 CC(C)(N)CCCO MCULE-7933621714 [0,2,0,0,0,0|1,0,0]=3 3544 B7R0.8 CC(C)(O)C#CCO MCULE-9832605272 [0,2,0,0,0,0|1,0,1]=4 3545 B7R0.8 CC(C)(O)CCCBr MCULE-5479502475 [0,2,0,0,0,0|2,0,0]=4 3546 B7R0.8 CC(C)(O)CCCN MCULE-1661840780 [0,2,0,0,0,0|2,0,0]=4 3547 B7R0.8 CC(C)(O)CCCO MCULE-1879136086 [0,2,0,0,0,0|1,0,0]=3 3548 B7R0.8 CC(Cl)(Cl)CCCN MCULE-9158528568 [0,2,0,0,0,0|2,0,0]=4 3549 B7R0.8 CC(F)(F)CCCBr MCULE-7834124234 [0,2,0,0,0,0|2,0,0]=4 3550 B7R0.8 CC(F)(F)CCCCl MCULE-6343526687 [0,2,0,0,0,0|2,0,0]=4 3551 B7R0.8 CC(F)(F)CCCN MCULE-4069688794 [0,2,0,0,0,0|2,0,0]=4 3552 B7R0.8 CC(F)(F)CCCN MCULE-8715137669 [0,2,0,0,0,0|2,0,0]=4 3553 B7R0.8 CC(F)(F)CCCO MCULE-1590790031 [0,2,0,0,0,0|1,0,0]=3 3554 B7R0.8 CCC#CC(C)(C)O MCULE-2859176039 [0,2,0,0,0,0|1,0,1]=4 3555 B7R0.8 CCCCC(C)(C)C MCULE-4446772090 [0,2,0,0,0,0|2,0,0]=4 3556 B7R0.8 CCCCC(C)(C)O MCULE-6518378731 [0,2,0,0,0,0|1,0,0]=3 3557 B7R0.8 CCCCC(F)(F)F MCULE-6313392272 [0,2,0,0,0,0|2,0,0]=4 3558 B7R0.8 CCCCP(=O)(O)O MCULE-8779445551 [0,2,0,0,0,0|2,0,0]=4 3559 B7R0.8 CCCCS(=O)(=O)O MCULE-8566681643 [0,2,0,0,0,0|2,0,0]=4 3560 B7R0.8 CCCNC(C)(C)C MCULE-3688632776 [0,2,0,0,0,0|2,0,0]=4 3561 B7R0.8 CCCNC(C)(C)C MCULE-5354845024 [0,2,0,0,0,0|2,0,0]=4 3562 B7R0.8 CCCOC(C)(C)C MCULE-4291970439 [0,2,0,0,0,0|1,0,0]=3 3563 B7R0.8 CCCOP(=O)(C)O MCULE-3556230581 [0,2,0,0,0,0|2,0,0]=4 3564 B7R0.8 CCCOP(=S)(C)[S-] MCULE-1450745735 [0,2,0,0,0,0|2,0,0]=4 3565 B7R0.8 CCCOP(=S)(C)[S-] MCULE-7731450470 [0,2,0,0,0,0|2,0,0]=4 3566 B7R0.8 CCCOS(=O)(=O)C MCULE-8443601449 [0,2,0,0,0,0|2,0,0]=4 3567 B7R0.8 CCNCC(C)(C)C MCULE-2346291870 [0,2,0,0,0,0|2,0,0]=4 3568 B7R0.8 CCNCC(C)(C)C MCULE-8357884831 [0,2,0,0,0,0|2,0,0]=4 3569 B7R0.8 CCNCC(C)(C)N MCULE-4574020293 [0,2,0,0,0,0|2,0,0]=4 3570 B7R0.8 CCNCC(C)(C)N MCULE-7739987843 [0,2,0,0,0,0|2,0,0]=4 3571 B7R0.8 CCNCC(C)(C)O MCULE-7989635881 [0,2,0,0,0,0|1,0,0]=3 3572 B7R0.8 CCNCC(C)(C)O MCULE-8539687825 [0,2,0,0,0,0|1,0,0]=3 3573 B7R0.8 CCNCC(F)(F)F MCULE-4960432667 [0,2,0,0,0,0|2,0,0]=4 3574 B7R0.8 CCNCC(F)(F)F MCULE-6184635365 [0,2,0,0,0,0|2,0,0]=4 3575 B7R0.8 CCOCC(C)(C)N MCULE-6273123648 [0,2,0,0,0,0|1,0,0]=3 3576 B7R0.8 CCOCC(C)(C)N MCULE-8688436281 [0,2,0,0,0,0|1,0,0]=3 3577 B7R0.8 CCOC[B-](F)(F)F MCULE-2671319292 [0,2,0,0,0,0|2,0,0]=4 3578 B7R0.8 CCOC[B-](F)(F)F MCULE-5158743789 [0,2,0,0,0,0|2,0,0]=4 3579 B7R0.8 CNCCC(C)(C)O MCULE-6866727490 [0,2,0,0,0,0|2,0,0]=4 3580 B7R0.8 CNOCC(F)(F)F MCULE-3870871112 [0,2,0,0,0,0|2,0,0]=4 3581 B7R0.8 CNOCC(F)(F)F MCULE-9995554125 [0,2,0,0,0,0|2,0,0]=4 3582 B7R0.8 CS(=O)(=O)CCCO MCULE-6816358475 [0,2,0,0,0,0|2,0,0]=4 3583 B7R0.8 CS(=O)(=O)NCCO MCULE-2565384564 [0,2,0,0,0,0|2,0,0]=4 3584 B7R0.8 CS(=O)(=O)OCCCl MCULE-8198079010 [0,2,0,0,0,0|2,0,0]=4 3585 B7R0.8 CS(=O)(=O)OCCF MCULE-7277769013 [0,2,0,0,0,0|2,0,0]=4 3586 B7R0.8 CS(=O)(=S)OCCBr MCULE-3017854867 [0,2,0,0,0,0|2,0,0]=4 3587 B7R0.8 CS(=O)(=S)OCCN MCULE-7727893446 [0,2,0,0,0,0|2,0,0]=4 3588 B7R0.8 CS(=O)(=S)OCCN MCULE-8197856093 [0,2,0,0,0,0|2,0,0]=4 3589 B7R0.8 C[Si](C)(C)CCCO MCULE-4140493646 [0,2,0,0,0,0|1,1,0]=4 3590 B7R0.8 C[Si](C)(C)OCCCl MCULE-1539145182 [0,2,0,0,0,0|1,1,0]=4 3591 B7R0.8 C[Si](C)(C)OCCI MCULE-7904217545 [0,2,0,0,0,0|1,1,0]=4 3592 B7R0.8 C[Si](C)(C)OCCN MCULE-2773772382 [0,2,0,0,0,0|1,1,0]=4 3593 B7R0.8 C[Si](C)(C)OCCO MCULE-3523451816 [0,2,0,0,0,0|0,1,0]=3 3594 B7R0.8 ClCOCC(Cl)(Cl)Cl MCULE-9535364227 [0,2,0,0,0,0|2,0,0]=4 3595 B7R0.8 FC(F)(F)COCCl MCULE-4011021534 [0,2,0,0,0,0|2,0,0]=4 3596 B7R0.8 FC(F)(F)OCCBr MCULE-1631985091 [0,2,0,0,0,0|2,0,0]=4 3597 B7R0.8 FC(F)(F)OCCCl MCULE-1162555625 [0,2,0,0,0,0|2,0,0]=4 3598 B7R0.8 FC(F)(F)OCCI MCULE-1640199290 [0,2,0,0,0,0|2,0,0]=4 3599 B7R0.8 NCCOC(F)(F)F MCULE-6314302567 [0,2,0,0,0,0|2,0,0]=4 3600 B7R0.8 NCCOC(F)(F)F MCULE-7072898911 [0,2,0,0,0,0|2,0,0]=4 3601 B7R0.8 OCCCC(F)(F)F MCULE-4890537356 [0,2,0,0,0,0|2,0,0]=4 3602 B7R0.8 OCCOC(F)(F)F MCULE-3014432643 [0,2,0,0,0,0|1,0,0]=3 3603 B7R0.8 OCCSC(F)(F)F MCULE-9421024850 [0,2,0,0,0,0|1,1,0]=4 3604 B7R0.1 BrCCCCCCBr MCULE-5187406804 [0,2,0,0,0,0|2,0,0]=4 3605 B7R0.1 BrCCSSCCBr MCULE-6795645587 [0,2,0,0,0,0|1,1,0]=4 3606 B7R0.1 C#CCCCCCBr MCULE-1618292603 [0,2,0,0,0,0|2,0,0]=4 3607 B7R0.1 C#CCCCCCC MCULE-4406928583 [0,2,0,0,0,0|2,0,0]=4 3608 B7R0.1 C#CCCCCCCl MCULE-2788042800 [0,2,0,0,0,0|2,0,0]=4 3609 B7R0.1 C#CCCCCCN MCULE-3067915237 [0,2,0,0,0,0|2,0,0]=4 3610 B7R0.1 C#CCCCCCO MCULE-2909503471 [0,2,0,0,0,0|1,0,0]=3 3611 B7R0.1 C#CCCOCC#C MCULE-6678340051 [0,2,0,0,0,0|1,0,1]=4 3612 B7R0.1 C#CCNCCCC MCULE-4241072719 [0,2,0,0,0,0|2,0,0]=4 3613 B7R0.1 C#CCNCCOC MCULE-3073014261 [0,2,0,0,0,0|1,0,1]=4 3614 B7R0.1 C#CCOCCC#N MCULE-7883616690 [0,2,0,0,0,0|1,0,1]=4 3615 B7R0.1 C#CCOCCCN MCULE-2240372630 [0,2,0,0,0,0|1,0,1]=4 3616 B7R0.1 C#CCOCCCN MCULE-8708564884 [0,2,0,0,0,0|1,0,1]=4 3617 B7R0.1 C#CCOCCCO MCULE-2600818859 [0,2,0,0,0,0|0,0,1]=3 3618 B7R0.1 C#CCOCCNC MCULE-6696412694 [0,2,0,0,0,0|1,0,1]=4 3619 B7R0.1 C#CCOCCNC MCULE-9126717873 [0,2,0,0,0,0|1,0,1]=4 3620 B7R0.1 C#CCOCCOC MCULE-4660359112 [0,2,0,0,0,0|0,0,1]=3 3621 B7R0.1 C#CCOCCON MCULE-9143099762 [0,2,0,0,0,0|0,0,1]=3 3622 B7R0.1 C/C=C/C#CCCO MCULE-9836763444 [0,2,0,0,0,0|1,0,1]=4 3623 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [0,2,0,0,0,0|2,0,0]=4 3624 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [0,2,0,0,0,0|2,0,0]=4 3625 B7R0.1 C=CCC#CCCO MCULE-2960075392 [0,2,0,0,0,0|1,0,1]=4 3626 B7R0.1 C=CCCCCCBr MCULE-7782876660 [0,2,0,0,0,0|2,0,0]=4 3627 B7R0.1 C=CCCCCCC MCULE-6867393536 [0,2,0,0,0,0|2,0,0]=4 3628 B7R0.1 C=CCCCCCCl MCULE-2205880878 [0,2,0,0,0,0|2,0,0]=4 3629 B7R0.1 C=CCCCCCI MCULE-1823596954 [0,2,0,0,0,0|2,0,0]=4 3630 B7R0.1 C=CCCCCCN MCULE-2913783474 [0,2,0,0,0,0|2,0,0]=4 3631 B7R0.1 C=CCCCCCN MCULE-9545708862 [0,2,0,0,0,0|2,0,0]=4 3632 B7R0.1 C=CCCCCCO MCULE-1200112990 [0,2,0,0,0,0|1,0,0]=3 3633 B7R0.1 C=CCCCCNC MCULE-3676018759 [0,2,0,0,0,0|2,0,0]=4 3634 B7R0.1 C=CCCCCNC MCULE-9443600983 [0,2,0,0,0,0|2,0,0]=4 3635 B7R0.1 C=CCCCCON MCULE-1155744928 [0,2,0,0,0,0|1,0,1]=4 3636 B7R0.1 C=CCCCCON MCULE-1741904620 [0,2,0,0,0,0|1,0,1]=4 3637 B7R0.1 C=CCCCNCC MCULE-2141378110 [0,2,0,0,0,0|2,0,0]=4 3638 B7R0.1 C=CCCCNCC MCULE-4269657694 [0,2,0,0,0,0|2,0,0]=4 3639 B7R0.1 C=CCCCOCCl MCULE-1172012073 [0,2,0,0,0,0|2,0,0]=4 3640 B7R0.1 C=CCCNCCO MCULE-8357008337 [0,2,0,0,0,0|1,0,0]=3 3641 B7R0.1 C=CCCOCCN MCULE-5958891740 [0,2,0,0,0,0|1,0,0]=3 3642 B7R0.1 C=CCCOCCO MCULE-5369849290 [0,2,0,0,0,0|0,0,0]=2 3643 B7R0.1 C=CCCSCCN MCULE-5541844264 [0,2,0,0,0,0|1,1,0]=4 3644 B7R0.1 C=CCNCCOC MCULE-6576578655 [0,2,0,0,0,0|1,0,1]=4 3645 B7R0.1 C=CCOCCC=O MCULE-3332311483 [0,2,0,0,0,0|0,0,2]=4 3646 B7R0.1 C=CCOCCCBr MCULE-7892533278 [0,2,0,0,0,0|1,0,1]=4 3647 B7R0.1 C=CCOCCCC MCULE-2214755289 [0,2,0,0,0,0|1,0,1]=4 3648 B7R0.1 C=CCOCCCN MCULE-4862923195 [0,2,0,0,0,0|1,0,1]=4 3649 B7R0.1 C=CCOCCOC MCULE-7363927527 [0,2,0,0,0,0|0,0,1]=3 3650 B7R0.1 C=CCSCCCC MCULE-4868736488 [0,2,0,0,0,0|2,0,0]=4 3651 B7R0.1 C=COCCCCC MCULE-4024159480 [0,2,0,0,0,0|1,0,0]=3 3652 B7R0.1 C=COCCCCO MCULE-3537265926 [0,2,0,0,0,0|0,0,2]=4 3653 B7R0.1 CC#CCCCCBr MCULE-3308414129 [0,2,0,0,0,0|2,0,0]=4 3654 B7R0.1 CC#CCCCCC MCULE-3651650902 [0,2,0,0,0,0|2,0,0]=4 3655 B7R0.1 CC#CCCCCO MCULE-8668355627 [0,2,0,0,0,0|1,0,0]=3 3656 B7R0.1 CC/C=C/CCCC MCULE-7439146649 [0,2,0,0,0,0|2,0,0]=4 3657 B7R0.1 CC/C=C\CCC=O MCULE-5862165111 [0,2,0,0,0,0|1,0,1]=4 3658 B7R0.1 CC/C=C\CCCO MCULE-7890119012 [0,2,0,0,0,0|1,0,0]=3 3659 B7R0.1 CC=CC#CCCO MCULE-2091422253 [0,2,0,0,0,0|1,0,1]=4 3660 B7R0.1 CC=CCCCCC MCULE-7111489659 [0,2,0,0,0,0|2,0,0]=4 3661 B7R0.1 CC=CCCCCO MCULE-8707373340 [0,2,0,0,0,0|1,0,0]=3 3662 B7R0.1 CCC#CCCCC MCULE-5815218275 [0,2,0,0,0,0|2,0,0]=4 3663 B7R0.1 CCC#CCOCC MCULE-8576147807 [0,2,0,0,0,0|1,0,0]=3 3664 B7R0.1 CCC/C=C/CCC MCULE-4580411068 [0,2,0,0,0,0|2,0,0]=4 3665 B7R0.1 CCC/C=C\CCC MCULE-3832748741 [0,2,0,0,0,0|2,0,0]=4 3666 B7R0.1 CCC=CC=CCO MCULE-7908131221 [0,2,0,0,0,0|1,0,1]=4 3667 B7R0.1 CCC=CCCC=O MCULE-1386777548 [0,2,0,0,0,0|1,0,1]=4 3668 B7R0.1 CCC=CCCCC MCULE-9716720293 [0,2,0,0,0,0|2,0,0]=4 3669 B7R0.1 CCC=CCCCO MCULE-9620732691 [0,2,0,0,0,0|1,0,0]=3 3670 B7R0.1 CCCC#CCCC MCULE-7777692011 [0,2,0,0,0,0|2,0,0]=4 3671 B7R0.1 CCCC#CCCO MCULE-7581204382 [0,2,0,0,0,0|1,0,0]=3 3672 B7R0.1 CCCC/C=C/CO MCULE-5404793542 [0,2,0,0,0,0|1,0,0]=3 3673 B7R0.1 CCCC=CCCC MCULE-6897310592 [0,2,0,0,0,0|2,0,0]=4 3674 B7R0.1 CCCC=CCCCl MCULE-5580394901 [0,2,0,0,0,0|2,0,0]=4 3675 B7R0.1 CCCCC#CCO MCULE-9057096480 [0,2,0,0,0,0|1,0,0]=3 3676 B7R0.1 CCCCC=CCBr MCULE-2427659057 [0,2,0,0,0,0|2,0,0]=4 3677 B7R0.1 CCCCC=CCO MCULE-7891403223 [0,2,0,0,0,0|1,0,0]=3 3678 B7R0.1 CCCCCC=CI MCULE-9964634818 [0,2,0,0,0,0|2,0,0]=4 3679 B7R0.1 CCCCCCC#N MCULE-7652123212 [0,2,0,0,0,0|2,0,0]=4 3680 B7R0.1 CCCCCCC=O MCULE-5251820425 [0,2,0,0,0,0|1,0,1]=4 3681 B7R0.1 CCCCCCCBr MCULE-8042829299 [0,2,0,0,0,0|2,0,0]=4 3682 B7R0.1 CCCCCCCC MCULE-3248084959 [0,2,0,0,0,0|2,0,0]=4 3683 B7R0.1 CCCCCCCCl MCULE-6286146566 [0,2,0,0,0,0|2,0,0]=4 3684 B7R0.1 CCCCCCCF MCULE-9794868174 [0,2,0,0,0,0|2,0,0]=4 3685 B7R0.1 CCCCCCCI MCULE-2930393920 [0,2,0,0,0,0|2,0,0]=4 3686 B7R0.1 CCCCCCCN MCULE-1126747714 [0,2,0,0,0,0|2,0,0]=4 3687 B7R0.1 CCCCCCCO MCULE-5882959353 [0,2,0,0,0,0|1,0,0]=3 3688 B7R0.1 CCCCCCCS MCULE-3901364910 [0,2,0,0,0,0|1,1,0]=4 3689 B7R0.1 CCCCCCNC MCULE-1828296852 [0,2,0,0,0,0|2,0,0]=4 3690 B7R0.1 CCCCCCNN MCULE-5116098983 [0,2,0,0,0,0|2,0,0]=4 3691 B7R0.1 CCCCCCNO MCULE-4175875706 [0,2,0,0,0,0|1,0,0]=3 3692 B7R0.1 CCCCCCNO MCULE-8719557426 [0,2,0,0,0,0|1,0,0]=3 3693 B7R0.1 CCCCCCOC MCULE-7148964901 [0,2,0,0,0,0|1,0,0]=3 3694 B7R0.1 CCCCCCON MCULE-1836746134 [0,2,0,0,0,0|1,0,0]=3 3695 B7R0.1 CCCCCCON MCULE-9566158736 [0,2,0,0,0,0|1,0,0]=3 3696 B7R0.1 CCCCCN=C=O MCULE-6020523044 [0,2,0,0,0,0|1,0,1]=4 3697 B7R0.1 CCCCCN=C=S MCULE-3433224152 [0,2,0,0,0,0|1,1,0]=4 3698 B7R0.1 CCCCCN=N#N MCULE-3738662950 [0,2,0,0,0,0|2,0,0]=4 3699 B7R0.1 CCCCCOC=O MCULE-2718009140 [0,2,0,0,0,0|1,0,0]=3 3700 B7R0.1 CCCCCOCC MCULE-6346670527 [0,2,0,0,0,0|1,0,0]=3 3701 B7R0.1 CCCCCON=O MCULE-8065075083 [0,2,0,0,0,0|1,0,0]=3 3702 B7R0.1 CCCCCSC#N MCULE-8334022047 [0,2,0,0,0,0|1,1,0]=4 3703 B7R0.1 CCCCNCC#N MCULE-1687580908 [0,2,0,0,0,0|2,0,0]=4 3704 B7R0.1 CCCCNCCC MCULE-6342731867 [0,2,0,0,0,0|2,0,0]=4 3705 B7R0.1 CCCCNCCN MCULE-3865190511 [0,2,0,0,0,0|2,0,0]=4 3706 B7R0.1 CCCCNCCO MCULE-3582031814 [0,2,0,0,0,0|1,0,0]=3 3707 B7R0.1 CCCCNCCS MCULE-6926403617 [0,2,0,0,0,0|1,1,0]=4 3708 B7R0.1 CCCCOCCBr MCULE-5314812532 [0,2,0,0,0,0|1,0,0]=3 3709 B7R0.1 CCCCOCCCl MCULE-9147804479 [0,2,0,0,0,0|1,0,0]=3 3710 B7R0.1 CCCCOCCI MCULE-3571589392 [0,2,0,0,0,0|1,0,0]=3 3711 B7R0.1 CCCCOCCN MCULE-1817743996 [0,2,0,0,0,0|1,0,0]=3 3712 B7R0.1 CCCCOCCN MCULE-3658840205 [0,2,0,0,0,0|1,0,0]=3 3713 B7R0.1 CCCCOCCO MCULE-1727546427 [0,2,0,0,0,0|0,0,0]=2 3714 B7R0.1 CCCCOCCO MCULE-4417721312 [0,2,0,0,0,0|0,0,0]=2 3715 B7R0.1 CCCCOCCS MCULE-7419398753 [0,2,0,0,0,0|0,1,0]=3 3716 B7R0.1 CCCCSCC#N MCULE-9529960668 [0,2,0,0,0,0|2,0,0]=4 3717 B7R0.1 CCCCSCCC MCULE-3137952516 [0,2,0,0,0,0|1,1,0]=4 3718 B7R0.1 CCCCSCCN MCULE-3521818954 [0,2,0,0,0,0|1,1,0]=4 3719 B7R0.1 CCCCSCCN MCULE-5281011566 [0,2,0,0,0,0|1,1,0]=4 3720 B7R0.1 CCCCSCCO MCULE-8791357083 [0,2,0,0,0,0|0,1,0]=3 3721 B7R0.1 CCCCSCCS MCULE-4109311315 [0,2,0,0,0,0|0,2,0]=4 3722 B7R0.1 CCCNCCC#N MCULE-4350757262 [0,2,0,0,0,0|2,0,0]=4 3723 B7R0.1 CCCNCCCN MCULE-6668094176 [0,2,0,0,0,0|2,0,0]=4 3724 B7R0.1 CCCNCCCO MCULE-4366982860 [0,2,0,0,0,0|1,0,0]=3 3725 B7R0.1 CCCNCCNC MCULE-3857593384 [0,2,0,0,0,0|2,0,0]=4 3726 B7R0.1 CCCNCCOC MCULE-4425567647 [0,2,0,0,0,0|1,0,0]=3 3727 B7R0.1 CCCNNCCC MCULE-1099710970 [0,2,0,0,0,0|2,0,0]=4 3728 B7R0.1 CCCNNCCC MCULE-3763521244 [0,2,0,0,0,0|2,0,0]=4 3729 B7R0.1 CCCOCCCN MCULE-5875738973 [0,2,0,0,0,0|1,0,0]=3 3730 B7R0.1 CCCSCCCN MCULE-2911445961 [0,2,0,0,0,0|1,1,0]=4 3731 B7R0.1 CCCSSCCC MCULE-2667977107 [0,2,0,0,0,0|1,1,0]=4 3732 B7R0.1 CCNCCCCO MCULE-4851249509 [0,2,0,0,0,0|1,0,0]=3 3733 B7R0.1 CCNCCNCC MCULE-2663126630 [0,2,0,0,0,0|2,0,0]=4 3734 B7R0.1 CCNCCNCC MCULE-8627955138 [0,2,0,0,0,0|2,0,0]=4 3735 B7R0.1 CCNCCNCC MCULE-9858982602 [0,2,0,0,0,0|2,0,0]=4 3736 B7R0.1 CCNCCOCC MCULE-8895991816 [0,2,0,0,0,0|1,0,0]=3 3737 B7R0.1 CCOC=NCC#N MCULE-4606188085 [0,2,0,0,0,0|1,0,1]=4 3738 B7R0.1 CCOCCCC#N MCULE-6256619755 [0,2,0,0,0,0|1,0,0]=3 3739 B7R0.1 CCOCCCCN MCULE-6583734908 [0,2,0,0,0,0|1,0,0]=3 3740 B7R0.1 CCOCCCCO MCULE-9986213119 [0,2,0,0,0,0|0,0,0]=2 3741 B7R0.1 CCOCCN=C=S MCULE-3401173404 [0,2,0,0,0,0|0,1,0]=3 3742 B7R0.1 CCOCCN=N#N MCULE-5023136876 [0,2,0,0,0,0|1,0,0]=3 3743 B7R0.1 CCOCCOCC MCULE-5593873009 [0,2,0,0,0,0|0,0,0]=2 3744 B7R0.1 CCONCCOC MCULE-2883736672 [0,2,0,0,0,0|0,0,0]=2 3745 B7R0.1 CCONCCOC MCULE-8885999080 [0,2,0,0,0,0|0,0,0]=2 3746 B7R0.1 CCSCCCC#N MCULE-4186353737 [0,2,0,0,0,0|1,1,0]=4 3747 B7R0.1 CCSCCCCN MCULE-7961306984 [0,2,0,0,0,0|1,1,0]=4 3748 B7R0.1 CCSCCCCO MCULE-1712194349 [0,2,0,0,0,0|0,1,0]=3 3749 B7R0.1 CCSCCSCC MCULE-2178899960 [0,2,0,0,0,0|0,2,0]=4 3750 B7R0.1 CNCCCCCN MCULE-8023367999 [0,2,0,0,0,0|2,0,0]=4 3751 B7R0.1 CNCCCCCO MCULE-2988249730 [0,2,0,0,0,0|1,0,0]=3 3752 B7R0.1 CNCCCCCO MCULE-8033733525 [0,2,0,0,0,0|1,0,0]=3 3753 B7R0.1 CNCCCCNC MCULE-4466243376 [0,2,0,0,0,0|2,0,0]=4 3754 B7R0.1 CNCCCCOC MCULE-3203262011 [0,2,0,0,0,0|1,0,0]=3 3755 B7R0.1 CNCCNCCN MCULE-6347214757 [0,2,0,0,0,0|2,0,0]=4 3756 B7R0.1 CNCCNCCN MCULE-8600289461 [0,2,0,0,0,0|2,0,0]=4 3757 B7R0.1 CNCCOCCCl MCULE-4700720996 [0,2,0,0,0,0|1,0,0]=3 3758 B7R0.1 CNCCOCCCl MCULE-6741879544 [0,2,0,0,0,0|1,0,0]=3 3759 B7R0.1 CNCCOCCN MCULE-8077914280 [0,2,0,0,0,0|1,0,0]=3 3760 B7R0.1 CNCCOCCO MCULE-7869540361 [0,2,0,0,0,0|0,0,0]=2 3761 B7R0.1 COCC#CCOC MCULE-7228915705 [0,2,0,0,0,0|1,0,1]=4 3762 B7R0.1 COCCCCC#N MCULE-5969342869 [0,2,0,0,0,0|1,0,1]=4 3763 B7R0.1 COCCCCCBr MCULE-9843465236 [0,2,0,0,0,0|1,0,0]=3 3764 B7R0.1 COCCCCCCl MCULE-6956815361 [0,2,0,0,0,0|1,0,0]=3 3765 B7R0.1 COCCCCCN MCULE-2109050097 [0,2,0,0,0,0|1,0,0]=3 3766 B7R0.1 COCCCCCO MCULE-6003118644 [0,2,0,0,0,0|1,0,0]=3 3767 B7R0.1 COCCCCOC MCULE-3614881304 [0,2,0,0,0,0|1,0,0]=3 3768 B7R0.1 COCCNCC#N MCULE-6690993214 [0,2,0,0,0,0|1,0,1]=4 3769 B7R0.1 COCCNCCF MCULE-1482164073 [0,2,0,0,0,0|1,0,0]=3 3770 B7R0.1 COCCNCCF MCULE-4419696614 [0,2,0,0,0,0|1,0,0]=3 3771 B7R0.1 COCCNCCN MCULE-4860380919 [0,2,0,0,0,0|1,0,0]=3 3772 B7R0.1 COCCNCCN MCULE-8558629867 [0,2,0,0,0,0|1,0,0]=3 3773 B7R0.1 COCCNCCO MCULE-3082225541 [0,2,0,0,0,0|1,0,0]=3 3774 B7R0.1 COCCOCC#N MCULE-9585469959 [0,2,0,0,0,0|0,0,1]=3 3775 B7R0.1 COCCOCC=O MCULE-2621317944 [0,2,0,0,0,0|0,0,1]=3 3776 B7R0.1 COCCOCCBr MCULE-7766640443 [0,2,0,0,0,0|0,0,0]=2 3777 B7R0.1 COCCOCCCl MCULE-5502842762 [0,2,0,0,0,0|0,0,0]=2 3778 B7R0.1 COCCOCCI MCULE-4051748367 [0,2,0,0,0,0|0,0,0]=2 3779 B7R0.1 COCCOCCN MCULE-7016705271 [0,2,0,0,0,0|0,0,0]=2 3780 B7R0.1 COCCOCCO MCULE-4230242952 [0,2,0,0,0,0|0,0,0]=2 3781 B7R0.1 COCCOCCS MCULE-5015015605 [0,2,0,0,0,0|0,0,0]=2 3782 B7R0.1 COCCSCCO MCULE-5057235828 [0,2,0,0,0,0|0,1,0]=3 3783 B7R0.1 COCOCCC#N MCULE-4331006522 [0,2,0,0,0,0|1,0,0]=3 3784 B7R0.1 COCOCCC=O MCULE-3632276453 [0,2,0,0,0,0|0,0,1]=3 3785 B7R0.1 COCOCCCN MCULE-4340598730 [0,2,0,0,0,0|1,0,0]=3 3786 B7R0.1 CSCCCCC#N MCULE-5901122432 [0,2,0,0,0,0|2,0,0]=4 3787 B7R0.1 CSCCCCCN MCULE-8771942873 [0,2,0,0,0,0|1,1,0]=4 3788 B7R0.1 CSCCCCCO MCULE-3422729293 [0,2,0,0,0,0|1,0,0]=3 3789 B7R0.1 ClCCCCCCBr MCULE-7471712605 [0,2,0,0,0,0|2,0,0]=4 3790 B7R0.1 ClCCCCCCCl MCULE-2423183693 [0,2,0,0,0,0|2,0,0]=4 3791 B7R0.1 ClCCCCCCI MCULE-2662361744 [0,2,0,0,0,0|2,0,0]=4 3792 B7R0.1 ClCCCCOCCl MCULE-6534731124 [0,2,0,0,0,0|2,0,0]=4 3793 B7R0.1 ClCCCNCCCl MCULE-1885721760 [0,2,0,0,0,0|2,0,0]=4 3794 B7R0.1 ClCCCNCCCl MCULE-9511755738 [0,2,0,0,0,0|2,0,0]=4 3795 B7R0.1 ClCCSSCCCl MCULE-5314855118 [0,2,0,0,0,0|1,1,0]=4 3796 B7R0.1 FCCCCCCBr MCULE-9238324978 [0,2,0,0,0,0|2,0,0]=4 3797 B7R0.1 ICCCCCCI MCULE-1005202656 [0,2,0,0,0,0|2,0,0]=4 3798 B7R0.1 N#CCCCCCBr MCULE-2014100603 [0,2,0,0,0,0|2,0,0]=4 3799 B7R0.1 N#CCCCCCCl MCULE-1324928568 [0,2,0,0,0,0|2,0,0]=4 3800 B7R0.1 N#CCCCCCN MCULE-4837507252 [0,2,0,0,0,0|2,0,0]=4 3801 B7R0.1 N#CCCNCCO MCULE-4867229301 [0,2,0,0,0,0|1,0,0]=3 3802 B7R0.1 N#CCCNCCO MCULE-9947925933 [0,2,0,0,0,0|1,0,0]=3 3803 B7R0.1 N#CCCOCCCl MCULE-9575015027 [0,2,0,0,0,0|1,0,0]=3 3804 B7R0.1 N#CCCOCCN MCULE-6674432245 [0,2,0,0,0,0|1,0,0]=3 3805 B7R0.1 N#CCCOCCN MCULE-8115918193 [0,2,0,0,0,0|1,0,0]=3 3806 B7R0.1 N#CCCOCCO MCULE-4006569384 [0,2,0,0,0,0|0,0,0]=2 3807 B7R0.1 N#CCCSCCO MCULE-6168568089 [0,2,0,0,0,0|0,1,0]=3 3808 B7R0.1 N#CCOCCCO MCULE-3858235861 [0,2,0,0,0,0|0,0,1]=3 3809 B7R0.1 N#N=NCCCCO MCULE-2102116751 [0,2,0,0,0,0|2,0,0]=4 3810 B7R0.1 NCCCCCCBr MCULE-4017495581 [0,2,0,0,0,0|2,0,0]=4 3811 B7R0.1 NCCCCCCBr MCULE-4048883510 [0,2,0,0,0,0|2,0,0]=4 3812 B7R0.1 NCCCCCCN MCULE-1038764376 [0,2,0,0,0,0|2,0,0]=4 3813 B7R0.1 NCCCCCCN MCULE-3766020930 [0,2,0,0,0,0|2,0,0]=4 3814 B7R0.1 NCCCCCCN MCULE-9535729200 [0,2,0,0,0,0|2,0,0]=4 3815 B7R0.1 NCCCCCCO MCULE-2264326846 [0,2,0,0,0,0|1,0,0]=3 3816 B7R0.1 NCCCCCCS MCULE-3764839885 [0,2,0,0,0,0|1,1,0]=4 3817 B7R0.1 NCCCCCCS MCULE-5822376723 [0,2,0,0,0,0|1,1,0]=4 3818 B7R0.1 NCCCNCCBr MCULE-3804557930 [0,2,0,0,0,0|2,0,0]=4 3819 B7R0.1 NCCCNCCBr MCULE-7533614613 [0,2,0,0,0,0|2,0,0]=4 3820 B7R0.1 NCCCNCCBr MCULE-9607733996 [0,2,0,0,0,0|2,0,0]=4 3821 B7R0.1 NCCCNCCN MCULE-4817006723 [0,2,0,0,0,0|2,0,0]=4 3822 B7R0.1 NCCCNCCO MCULE-1084481336 [0,2,0,0,0,0|1,0,0]=3 3823 B7R0.1 NCCCNCCS MCULE-2204209594 [0,2,0,0,0,0|1,1,0]=4 3824 B7R0.1 NCCCNCCS MCULE-8506055366 [0,2,0,0,0,0|1,1,0]=4 3825 B7R0.1 NCCCOCCO MCULE-7244821044 [0,2,0,0,0,0|0,0,0]=2 3826 B7R0.1 NCCNCCCO MCULE-6476789217 [0,2,0,0,0,0|1,0,0]=3 3827 B7R0.1 NCCOCCCO MCULE-2435588099 [0,2,0,0,0,0|0,0,0]=2 3828 B7R0.1 NCCOCCCO MCULE-9188421727 [0,2,0,0,0,0|0,0,0]=2 3829 B7R0.1 NCCSCCCO MCULE-1578023056 [0,2,0,0,0,0|0,1,0]=3 3830 B7R0.1 NCCSSCCN MCULE-4713604405 [0,2,0,0,0,0|1,1,0]=4 3831 B7R0.1 NCCSSCCN MCULE-4801024099 [0,2,0,0,0,0|1,1,0]=4 3832 B7R0.1 NCCSSCCN MCULE-9351804410 [0,2,0,0,0,0|1,1,0]=4 3833 B7R0.1 NCCSSCCO MCULE-1512873976 [0,2,0,0,0,0|0,1,0]=3 3834 B7R0.1 NCC[Se][Se]CCN MCULE-3008791235 [0,2,0,0,0,0|1,1,0]=4 3835 B7R0.1 NCC[Se][Se]CCN MCULE-9995399290 [0,2,0,0,0,0|1,1,0]=4 3836 B7R0.1 NOCCOCCO MCULE-7815173940 [0,2,0,0,0,0|0,0,0]=2 3837 B7R0.1 O=CCCCCCBr MCULE-7014516847 [0,2,0,0,0,0|1,0,1]=4 3838 B7R0.1 O=CCCCCCCl MCULE-8269912560 [0,2,0,0,0,0|1,0,1]=4 3839 B7R0.1 O=CCCCCCF MCULE-8174281286 [0,2,0,0,0,0|1,0,1]=4 3840 B7R0.1 O=CCCCCCO MCULE-3978349845 [0,2,0,0,0,0|1,0,0]=3 3841 B7R0.1 O=CCCCCCO MCULE-4997016680 [0,2,0,0,0,0|1,0,0]=3 3842 B7R0.1 O=COCCOC=O MCULE-6942322322 [0,2,0,0,0,0|1,0,1]=4 3843 B7R0.1 OCCC=CCCO MCULE-7933051592 [0,2,0,0,0,0|1,0,0]=3 3844 B7R0.1 OCCCCCCBr MCULE-3500356936 [0,2,0,0,0,0|1,0,0]=3 3845 B7R0.1 OCCCCCCCl MCULE-4507452440 [0,2,0,0,0,0|1,0,0]=3 3846 B7R0.1 OCCCCCCF MCULE-7082491218 [0,2,0,0,0,0|1,0,0]=3 3847 B7R0.1 OCCCCCCI MCULE-3710706648 [0,2,0,0,0,0|1,0,0]=3 3848 B7R0.1 OCCCCCCO MCULE-8817570517 [0,2,0,0,0,0|1,0,0]=3 3849 B7R0.1 OCCCCCCS MCULE-9135853131 [0,2,0,0,0,0|1,0,0]=3 3850 B7R0.1 OCCCNCCO MCULE-1959450493 [0,2,0,0,0,0|1,0,0]=3 3851 B7R0.1 OCCCOCCCl MCULE-9172390990 [0,2,0,0,0,0|0,0,0]=2 3852 B7R0.1 OCCNNCCO MCULE-5335815164 [0,2,0,0,0,0|1,0,0]=3 3853 B7R0.1 OCCOCCCBr MCULE-3397483886 [0,2,0,0,0,0|0,0,0]=2 3854 B7R0.1 OCCSSCCO MCULE-9443383082 [0,2,0,0,0,0|0,1,0]=3 3855 B7R0.1 SCCCCCCS MCULE-2873828857 [0,2,0,0,0,0|1,1,0]=4 3856 B7R0.1 [NH3+]CCCCCC[NH3+] MCULE-2211304471 [0,2,0,0,0,0|2,0,0]=4 3857 B7R0.1 [NH3+]CCC[NH2+]CCS MCULE-5394269788 [0,2,0,0,0,0|1,1,0]=4 3858 B7R0.1 [NH3+]CCSSCC[NH3+] MCULE-3814449504 [0,2,0,0,0,0|1,1,0]=4 3859 B5R1.1 B1CCOO1 MCULE-4859234466 [1,0,0,1,0,0|2,0,0]=4 3860 B5R1.1 C1=CCCC1 MCULE-8785635218 [1,0,0,1,0,0|1,0,1]=4 3861 B5R1.1 C1=CCOC1 MCULE-1252378718 [1,0,0,1,0,0|0,0,2]=4 3862 B5R1.1 C1=COCC1 MCULE-7714726225 [1,0,0,1,0,0|0,0,2]=4 3863 B5R1.1 C1CCNC1 MCULE-2816679267 [1,0,0,1,0,0|1,0,0]=3 3864 B5R1.1 C1CCNC1 MCULE-8439725600 [1,0,0,1,0,0|1,0,0]=3 3865 B5R1.1 C1CCNC1 MCULE-8653165010 [1,0,0,1,0,0|1,0,0]=3 3866 B5R1.1 C1CCNC1 MCULE-9053007443 [1,0,0,1,0,0|1,0,0]=3 3867 B5R1.1 C1CCOC1 MCULE-3873245085 [1,0,0,1,0,0|0,0,0]=2 3868 B5R1.1 C1CCSC1 MCULE-4519380555 [1,0,0,1,0,0|0,1,0]=3 3869 B5R1.1 C1CNCN1 MCULE-6666768806 [1,0,0,1,0,0|2,0,0]=4 3870 B5R1.1 C1CNNC1 MCULE-9192384720 [1,0,0,1,0,0|2,0,0]=4 3871 B5R1.1 C1CNNC1 MCULE-9418244562 [1,0,0,1,0,0|2,0,0]=4 3872 B5R1.1 C1CNOC1 MCULE-3922840312 [1,0,0,1,0,0|1,0,0]=3 3873 B5R1.1 C1CNOC1 MCULE-6084499894 [1,0,0,1,0,0|1,0,0]=3 3874 B5R1.1 C1COCN1 MCULE-4693733872 [1,0,0,1,0,0|1,0,0]=3 3875 B5R1.1 C1COCO1 MCULE-3967810235 [1,0,0,1,0,0|0,0,0]=2 3876 B5R1.1 C1CSCN1 MCULE-1445529876 [1,0,0,1,0,0|1,1,0]=4 3877 B5R1.1 C1CSCN1 MCULE-8646299838 [1,0,0,1,0,0|1,1,0]=4 3878 B5R1.1 C1CSCS1 MCULE-2954642463 [1,0,0,1,0,0|0,2,0]=4 3879 B5R1.2 BrC1CCC1 MCULE-3713567804 [1,0,0,1,0,0|1,0,0]=3 3880 B5R1.2 BrC1CNC1 MCULE-4959282437 [1,0,0,1,0,0|2,0,0]=4 3881 B5R1.2 BrC1CNC1 MCULE-5635086924 [1,0,0,1,0,0|2,0,0]=4 3882 B5R1.2 BrC1CNC1 MCULE-7561312043 [1,0,0,1,0,0|2,0,0]=4 3883 B5R1.2 BrC1COC1 MCULE-7527620035 [1,0,0,1,0,0|1,0,0]=3 3884 B5R1.2 C=C1CCC1 MCULE-8318650413 [1,0,0,1,0,0|1,0,1]=4 3885 B5R1.2 C=C1COC1 MCULE-1822645869 [1,0,0,1,0,0|1,0,1]=4 3886 B5R1.2 CC1CCN1 MCULE-7952714343 [1,0,0,1,0,0|1,0,0]=3 3887 B5R1.2 CC1CCN1 MCULE-9084374728 [1,0,0,1,0,0|1,0,0]=3 3888 B5R1.2 CC1CNC1 MCULE-3977066574 [1,0,0,1,0,0|2,0,0]=4 3889 B5R1.2 CC1CNC1 MCULE-7868611457 [1,0,0,1,0,0|2,0,0]=4 3890 B5R1.2 C[C@@H]1CCN1 MCULE-1326888606 [1,0,0,1,0,0|1,0,0]=3 3891 B5R1.2 C[C@@H]1CCN1 MCULE-4242598105 [1,0,0,1,0,0|1,0,0]=3 3892 B5R1.2 C[C@@H]1CCN1 MCULE-7982357684 [1,0,0,1,0,0|1,0,0]=3 3893 B5R1.2 C[C@@H]1CCN1 MCULE-9443505478 [1,0,0,1,0,0|1,0,0]=3 3894 B5R1.2 C[C@H]1CCN1 MCULE-3178162849 [1,0,0,1,0,0|1,0,0]=3 3895 B5R1.2 C[C@H]1CCN1 MCULE-4001397038 [1,0,0,1,0,0|1,0,0]=3 3896 B5R1.2 C[C@H]1CCN1 MCULE-4361200248 [1,0,0,1,0,0|1,0,0]=3 3897 B5R1.2 C[C@H]1CCN1 MCULE-6534579029 [1,0,0,1,0,0|1,0,0]=3 3898 B5R1.2 ClC1CCC1 MCULE-2602937313 [1,0,0,1,0,0|1,0,0]=3 3899 B5R1.2 ClC1CNC1 MCULE-2051705029 [1,0,0,1,0,0|2,0,0]=4 3900 B5R1.2 ClC1CNC1 MCULE-6678325694 [1,0,0,1,0,0|2,0,0]=4 3901 B5R1.2 ClC1COC1 MCULE-7266812470 [1,0,0,1,0,0|1,0,0]=3 3902 B5R1.2 FC1CNC1 MCULE-5746598794 [1,0,0,1,0,0|2,0,0]=4 3903 B5R1.2 FC1CNC1 MCULE-9427948721 [1,0,0,1,0,0|2,0,0]=4 3904 B5R1.2 FC1COC1 MCULE-7899811313 [1,0,0,1,0,0|1,0,0]=3 3905 B5R1.2 IC1CCC1 MCULE-3890796264 [1,0,0,1,0,0|1,0,0]=3 3906 B5R1.2 IC1CNC1 MCULE-5957681014 [1,0,0,1,0,0|2,0,0]=4 3907 B5R1.2 IC1CNC1 MCULE-7396587981 [1,0,0,1,0,0|2,0,0]=4 3908 B5R1.2 IC1COC1 MCULE-6736781201 [1,0,0,1,0,0|1,0,0]=3 3909 B5R1.2 NC1CCC1 MCULE-7511834789 [1,0,0,1,0,0|1,0,0]=3 3910 B5R1.2 NC1CCC1 MCULE-9118406840 [1,0,0,1,0,0|1,0,0]=3 3911 B5R1.2 NC1CNC1 MCULE-3069271350 [1,0,0,1,0,0|2,0,0]=4 3912 B5R1.2 NC1CNC1 MCULE-4785323807 [1,0,0,1,0,0|2,0,0]=4 3913 B5R1.2 NC1COC1 MCULE-3457998413 [1,0,0,1,0,0|1,0,0]=3 3914 B5R1.2 NC1COC1 MCULE-8439862131 [1,0,0,1,0,0|1,0,0]=3 3915 B5R1.2 NC1CSC1 MCULE-8155396913 [1,0,0,1,0,0|1,1,0]=4 3916 B5R1.2 NC1CSC1 MCULE-8463545676 [1,0,0,1,0,0|1,1,0]=4 3917 B5R1.2 NC1CSC1 MCULE-8920812656 [1,0,0,1,0,0|1,1,0]=4 3918 B5R1.2 NN1CCC1 MCULE-8176731673 [1,0,0,1,0,0|2,0,0]=4 3919 B5R1.2 NN1CCC1 MCULE-8382619719 [1,0,0,1,0,0|2,0,0]=4 3920 B5R1.2 O=C1CCC1 MCULE-4870967355 [1,0,0,1,0,0|0,0,2]=4 3921 B5R1.2 O=C1CCO1 MCULE-1277069147 [1,0,0,1,0,0|0,0,2]=4 3922 B5R1.2 O=C1COC1 MCULE-6847248632 [1,0,0,1,0,0|0,0,2]=4 3923 B5R1.2 OC1CCC1 MCULE-2856311430 [1,0,0,1,0,0|0,0,0]=2 3924 B5R1.2 OC1CNC1 MCULE-3596383447 [1,0,0,1,0,0|1,0,0]=3 3925 B5R1.2 OC1CNC1 MCULE-7913518128 [1,0,0,1,0,0|1,0,0]=3 3926 B5R1.2 OC1COC1 MCULE-2630355859 [1,0,0,1,0,0|0,0,0]=2 3927 B5R1.2 OC1CSC1 MCULE-6759275460 [1,0,0,1,0,0|0,1,0]=3 3928 B5R1.2 SC1CCC1 MCULE-1779239394 [1,0,0,1,0,0|0,1,0]=3 3929 B5R1.2 SC1CNC1 MCULE-5823473779 [1,0,0,1,0,0|1,1,0]=4 3930 B5R1.2 SC1CNC1 MCULE-9002536698 [1,0,0,1,0,0|1,1,0]=4 3931 B5R1.2 SC1COC1 MCULE-2175099379 [1,0,0,1,0,0|0,1,0]=3 3932 B5R1.3 BrCC1CC1 MCULE-6057571576 [1,0,0,1,0,0|1,0,0]=3 3933 B5R1.3 BrCC1CO1 MCULE-1054784183 [1,0,0,1,0,0|1,0,0]=3 3934 B5R1.3 C#CC1CC1 MCULE-8413731516 [1,0,0,1,0,0|1,0,1]=4 3935 B5R1.3 C1(CO1)CCl MCULE-2239256431 [1,0,0,1,0,0|1,0,0]=3 3936 B5R1.3 C=CC1CC1 MCULE-4323158851 [1,0,0,1,0,0|1,0,1]=4 3937 B5R1.3 C=CC1CO1 MCULE-1428696186 [1,0,0,1,0,0|0,0,2]=4 3938 B5R1.3 CCC1CO1 MCULE-4316722229 [1,0,0,1,0,0|0,0,0]=2 3939 B5R1.3 CCC1CO1 MCULE-8341828978 [1,0,0,1,0,0|0,0,0]=2 3940 B5R1.3 CC[C@@H]1CO1 MCULE-4349820919 [1,0,0,1,0,0|0,0,0]=2 3941 B5R1.3 CC[C@@H]1CO1 MCULE-5929218989 [1,0,0,1,0,0|0,0,0]=2 3942 B5R1.3 CC[C@H]1CO1 MCULE-3647278168 [1,0,0,1,0,0|0,0,0]=2 3943 B5R1.3 CC[C@H]1CO1 MCULE-4369524443 [1,0,0,1,0,0|0,0,0]=2 3944 B5R1.3 CNC1CC1 MCULE-4055097650 [1,0,0,1,0,0|2,0,0]=4 3945 B5R1.3 CNC1CC1 MCULE-8040280524 [1,0,0,1,0,0|2,0,0]=4 3946 B5R1.3 ClCC1CC1 MCULE-3906493674 [1,0,0,1,0,0|1,0,0]=3 3947 B5R1.3 ClCC1CO1 MCULE-9759519789 [1,0,0,1,0,0|1,0,0]=3 3948 B5R1.3 ClCC1CS1 MCULE-7368175691 [1,0,0,1,0,0|1,1,0]=4 3949 B5R1.3 ClC[C@@H]1CO1 MCULE-8144448889 [1,0,0,1,0,0|1,0,0]=3 3950 B5R1.3 ClC[C@@H]1CO1 MCULE-8710235870 [1,0,0,1,0,0|1,0,0]=3 3951 B5R1.3 ClC[C@H]1CO1 MCULE-2316124162 [1,0,0,1,0,0|1,0,0]=3 3952 B5R1.3 ClC[C@H]1CO1 MCULE-6957304600 [1,0,0,1,0,0|1,0,0]=3 3953 B5R1.3 FCC1CO1 MCULE-6156138745 [1,0,0,1,0,0|1,0,0]=3 3954 B5R1.3 FC[C@@H]1CO1 MCULE-7477932707 [1,0,0,1,0,0|1,0,0]=3 3955 B5R1.3 FNC1CC1 MCULE-4155496114 [1,0,0,1,0,0|2,0,0]=4 3956 B5R1.3 ICC1CC1 MCULE-2390979991 [1,0,0,1,0,0|1,0,0]=3 3957 B5R1.3 ICC1CO1 MCULE-6993621560 [1,0,0,1,0,0|1,0,0]=3 3958 B5R1.3 N#CC1CC1 MCULE-1838359731 [1,0,0,1,0,0|1,0,1]=4 3959 B5R1.3 NCC1CC1 MCULE-5832294538 [1,0,0,1,0,0|1,0,0]=3 3960 B5R1.3 NCC1CC1 MCULE-9914994928 [1,0,0,1,0,0|1,0,0]=3 3961 B5R1.3 NNC1CC1 MCULE-3522729516 [1,0,0,1,0,0|2,0,0]=4 3962 B5R1.3 NNC1CC1 MCULE-7121199703 [1,0,0,1,0,0|2,0,0]=4 3963 B5R1.3 NNC1CC1 MCULE-8598538666 [1,0,0,1,0,0|2,0,0]=4 3964 B5R1.3 NOC1CC1 MCULE-5379816123 [1,0,0,1,0,0|2,0,0]=4 3965 B5R1.3 O=CC1CC1 MCULE-9773190262 [1,0,0,1,0,0|0,0,2]=4 3966 B5R1.3 OCC1CC1 MCULE-4492474357 [1,0,0,1,0,0|0,0,0]=2 3967 B5R1.3 OCC1CO1 MCULE-2158628585 [1,0,0,1,0,0|0,0,0]=2 3968 B5R1.3 OCC1CO1 MCULE-4063620133 [1,0,0,1,0,0|0,0,0]=2 3969 B5R1.3 OC[C@@H]1CO1 MCULE-4213198809 [1,0,0,1,0,0|0,0,0]=2 3970 B5R1.3 OC[C@@H]1CO1 MCULE-6922911793 [1,0,0,1,0,0|0,0,0]=2 3971 B5R1.3 OC[C@H]1CO1 MCULE-2018407404 [1,0,0,1,0,0|0,0,0]=2 3972 B5R1.3 OC[C@H]1CO1 MCULE-9773081927 [1,0,0,1,0,0|0,0,0]=2 3973 B5R1.3 SCC1CC1 MCULE-9557919804 [1,0,0,1,0,0|0,1,0]=3 3974 B5R1.3 [C@@H]1(CO1)C=C MCULE-9776744095 [1,0,0,1,0,0|0,0,2]=4 3975 B5R1.3 [C@H]1(CO1)C=C MCULE-7934901088 [1,0,0,1,0,0|0,0,2]=4 3976 B5R1.4 CC1CC1N MCULE-4472318973 [1,0,0,1,0,0|1,0,0]=3 3977 B5R1.4 CC1CC1N MCULE-8037315228 [1,0,0,1,0,0|1,0,0]=3 3978 B5R1.4 CC1CC1O MCULE-2006758475 [1,0,0,1,0,0|0,0,0]=2 3979 B5R1.4 CC1OC1C MCULE-9780363671 [1,0,0,1,0,0|0,0,0]=2 3980 B5R1.4 C[C@@H]1C[C@@H]1N MCULE-6282896395 [1,0,0,1,0,0|1,0,0]=3 3981 B5R1.4 C[C@@H]1C[C@H]1N MCULE-1526017761 [1,0,0,1,0,0|1,0,0]=3 3982 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7111745511 [1,0,0,1,0,0|1,0,0]=3 3983 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7879046644 [1,0,0,1,0,0|1,0,0]=3 3984 B5R1.4 C[C@@H]1C[C@H]1N MCULE-9805986423 [1,0,0,1,0,0|1,0,0]=3 3985 B5R1.4 C[C@@H]1O[C@@H]1C MCULE-4355544092 [1,0,0,1,0,0|0,0,0]=2 3986 B5R1.4 C[C@@H]1O[C@H]1C MCULE-1930253682 [1,0,0,1,0,0|0,0,0]=2 3987 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9525222696 [1,0,0,1,0,0|1,0,0]=3 3988 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9658987958 [1,0,0,1,0,0|1,0,0]=3 3989 B5R1.4 C[C@H]1C[C@H]1N MCULE-4953477750 [1,0,0,1,0,0|1,0,0]=3 3990 B5R1.4 C[C@H]1C[C@H]1N MCULE-6429810931 [1,0,0,1,0,0|1,0,0]=3 3991 B5R1.4 C[C@H]1O[C@@H]1C MCULE-4354089942 [1,0,0,1,0,0|0,0,0]=2 3992 B5R1.4 C[C@H]1O[C@@H]1C MCULE-7982793342 [1,0,0,1,0,0|0,0,0]=2 3993 B5R1.4 FC1CC1Br MCULE-9881614971 [1,0,0,1,0,0|2,0,0]=4 3994 B5R1.4 NC1CC1F MCULE-8246845073 [1,0,0,1,0,0|2,0,0]=4 3995 B5R1.4 NC1CC1F MCULE-9705431616 [1,0,0,1,0,0|2,0,0]=4 3996 B5R1.4 NC1CC1N MCULE-2596247889 [1,0,0,1,0,0|2,0,0]=4 3997 B5R1.4 NC1CC1N MCULE-7859500244 [1,0,0,1,0,0|2,0,0]=4 3998 B5R1.4 NC1CC1O MCULE-2677451452 [1,0,0,1,0,0|1,0,0]=3 3999 B5R1.4 NC1CC1O MCULE-2909581707 [1,0,0,1,0,0|1,0,0]=3 4000 B5R1.4 NC1C[C@@H]1F MCULE-6104198419 [1,0,0,1,0,0|2,0,0]=4 4001 B5R1.4 NC1C[C@@H]1F MCULE-8327037761 [1,0,0,1,0,0|2,0,0]=4 4002 B5R1.4 N[C@@H]1C[C@@H]1F MCULE-1523759808 [1,0,0,1,0,0|2,0,0]=4 4003 B5R1.4 N[C@@H]1C[C@@H]1F MCULE-1966857090 [1,0,0,1,0,0|2,0,0]=4 4004 B5R1.4 N[C@@H]1C[C@@H]1F MCULE-3541599795 [1,0,0,1,0,0|2,0,0]=4 4005 B5R1.4 N[C@@H]1C[C@@H]1F MCULE-8279324103 [1,0,0,1,0,0|2,0,0]=4 4006 B5R1.4 N[C@@H]1C[C@@H]1O MCULE-1950197706 [1,0,0,1,0,0|1,0,0]=3 4007 B5R1.4 N[C@@H]1C[C@H]1F MCULE-1379839035 [1,0,0,1,0,0|2,0,0]=4 4008 B5R1.4 N[C@@H]1C[C@H]1F MCULE-7084330140 [1,0,0,1,0,0|2,0,0]=4 4009 B5R1.4 N[C@@H]1C[C@H]1F MCULE-7552076798 [1,0,0,1,0,0|2,0,0]=4 4010 B5R1.4 N[C@@H]1C[C@H]1F MCULE-7897288338 [1,0,0,1,0,0|2,0,0]=4 4011 B5R1.4 N[C@@H]1C[C@H]1N MCULE-3447984641 [1,0,0,1,0,0|2,0,0]=4 4012 B5R1.4 N[C@@H]1C[C@H]1N MCULE-6823903337 [1,0,0,1,0,0|2,0,0]=4 4013 B5R1.4 N[C@@H]1C[C@H]1N MCULE-7464483331 [1,0,0,1,0,0|2,0,0]=4 4014 B5R1.4 N[C@@H]1C[C@H]1N MCULE-8962336863 [1,0,0,1,0,0|2,0,0]=4 4015 B5R1.4 N[C@@H]1C[C@H]1O MCULE-5188790849 [1,0,0,1,0,0|1,0,0]=3 4016 B5R1.4 N[C@@H]1C[C@H]1O MCULE-8531829585 [1,0,0,1,0,0|1,0,0]=3 4017 B5R1.4 N[C@H]1C[C@@H]1F MCULE-2098980306 [1,0,0,1,0,0|2,0,0]=4 4018 B5R1.4 N[C@H]1C[C@@H]1F MCULE-4142129455 [1,0,0,1,0,0|2,0,0]=4 4019 B5R1.4 N[C@H]1C[C@@H]1F MCULE-8616633135 [1,0,0,1,0,0|2,0,0]=4 4020 B5R1.4 N[C@H]1C[C@@H]1F MCULE-8788279695 [1,0,0,1,0,0|2,0,0]=4 4021 B5R1.4 N[C@H]1C[C@@H]1N MCULE-3374448650 [1,0,0,1,0,0|2,0,0]=4 4022 B5R1.4 N[C@H]1C[C@@H]1N MCULE-3782038729 [1,0,0,1,0,0|2,0,0]=4 4023 B5R1.4 N[C@H]1C[C@@H]1N MCULE-7583094160 [1,0,0,1,0,0|2,0,0]=4 4024 B5R1.4 N[C@H]1C[C@@H]1O MCULE-4699241997 [1,0,0,1,0,0|1,0,0]=3 4025 B5R1.4 N[C@H]1C[C@H]1F MCULE-1665232627 [1,0,0,1,0,0|2,0,0]=4 4026 B5R1.4 N[C@H]1C[C@H]1F MCULE-1941678287 [1,0,0,1,0,0|2,0,0]=4 4027 B5R1.4 N[C@H]1C[C@H]1F MCULE-3275343851 [1,0,0,1,0,0|2,0,0]=4 4028 B5R1.4 N[C@H]1C[C@H]1F MCULE-5308534229 [1,0,0,1,0,0|2,0,0]=4 4029 B5R1.4 N[C@H]1C[C@H]1N MCULE-1426528738 [1,0,0,1,0,0|2,0,0]=4 4030 B5R1.4 N[C@H]1C[C@H]1N MCULE-6003446819 [1,0,0,1,0,0|2,0,0]=4 4031 B5R1.4 N[C@H]1C[C@H]1O MCULE-3609246488 [1,0,0,1,0,0|1,0,0]=3 4032 B5R1.4 N[C@H]1C[C@H]1O MCULE-3860963329 [1,0,0,1,0,0|1,0,0]=3 4033 B5R1.4 [C@@H]1(C[C@H]1N)F MCULE-5118118569 [1,0,0,1,0,0|2,0,0]=4 4034 B5R1.4 [C@H]1(C[C@H]1F)N MCULE-1071128348 [1,0,0,1,0,0|2,0,0]=4 4035 B5R1.4 [C@H]1(C[C@H]1F)N MCULE-8956631145 [1,0,0,1,0,0|2,0,0]=4 4036 B7R1.1 BrCC1C=CCC1 MCULE-4270104932 [0,1,0,1,0,0|2,0,0]=4 4037 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [0,1,0,1,0,0|2,0,0]=4 4038 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [0,1,0,1,0,0|2,0,0]=4 4039 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [0,1,0,1,0,0|2,0,0]=4 4040 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [0,1,0,1,0,0|2,0,0]=4 4041 B7R1.1 BrCC1CCCO1 MCULE-6801721633 [0,1,0,1,0,0|1,0,0]=3 4042 B7R1.1 BrCC1CCNC1 MCULE-3841325509 [0,1,0,1,0,0|2,0,0]=4 4043 B7R1.1 BrCC1CCNC1 MCULE-4302321173 [0,1,0,1,0,0|2,0,0]=4 4044 B7R1.1 BrCC1CCNC1 MCULE-7802125485 [0,1,0,1,0,0|2,0,0]=4 4045 B7R1.1 BrCC1CCOC1 MCULE-5109533414 [0,1,0,1,0,0|1,0,0]=3 4046 B7R1.1 BrCC1OCCO1 MCULE-4843503125 [0,1,0,1,0,0|0,0,0]=2 4047 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [0,1,0,1,0,0|2,0,0]=4 4048 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [0,1,0,1,0,0|2,0,0]=4 4049 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [0,1,0,1,0,0|2,0,0]=4 4050 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [0,1,0,1,0,0|2,0,0]=4 4051 B7R1.1 BrC[C@H]1CCCO1 MCULE-3468061610 [0,1,0,1,0,0|1,0,0]=3 4052 B7R1.1 BrC[C@H]1CCCO1 MCULE-9305844681 [0,1,0,1,0,0|1,0,0]=3 4053 B7R1.1 BrC[C@H]1CCOC1 MCULE-3326059942 [0,1,0,1,0,0|1,0,0]=3 4054 B7R1.1 C#CC1CCCC1 MCULE-2058689962 [0,1,0,1,0,0|2,0,0]=4 4055 B7R1.1 C#CC1CCCO1 MCULE-5501627253 [0,1,0,1,0,0|1,0,1]=4 4056 B7R1.1 C#CC1CCNC1 MCULE-5702093443 [0,1,0,1,0,0|2,0,0]=4 4057 B7R1.1 C#CC1CCNC1 MCULE-8837025112 [0,1,0,1,0,0|2,0,0]=4 4058 B7R1.1 C#CC1CCOC1 MCULE-6007232344 [0,1,0,1,0,0|1,0,0]=3 4059 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [0,1,0,1,0,0|2,0,0]=4 4060 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [0,1,0,1,0,0|2,0,0]=4 4061 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [0,1,0,1,0,0|2,0,0]=4 4062 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [0,1,0,1,0,0|2,0,0]=4 4063 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [0,1,0,1,0,0|1,0,0]=3 4064 B7R1.1 C1(CCNC1)CC MCULE-1733412139 [0,1,0,1,0,0|2,0,0]=4 4065 B7R1.1 C1(CCNC1)CC MCULE-9295480110 [0,1,0,1,0,0|2,0,0]=4 4066 B7R1.1 C1(CCNC1)CO MCULE-7897000858 [0,1,0,1,0,0|1,0,0]=3 4067 B7R1.1 C1(CCNC1)CO MCULE-9939548436 [0,1,0,1,0,0|1,0,0]=3 4068 B7R1.1 C1(CCNC1)OC MCULE-4107032989 [0,1,0,1,0,0|1,0,0]=3 4069 B7R1.1 C1(CCNC1)OC MCULE-7879953493 [0,1,0,1,0,0|1,0,0]=3 4070 B7R1.1 C1(CCOC1)CN MCULE-1674920995 [0,1,0,1,0,0|1,0,0]=3 4071 B7R1.1 C1(CCOC1)CN MCULE-9715233219 [0,1,0,1,0,0|1,0,0]=3 4072 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [0,1,0,1,0,0|0,0,0]=2 4073 B7R1.1 C1(CCOC1)NC MCULE-8636753374 [0,1,0,1,0,0|1,0,0]=3 4074 B7R1.1 C=CC1CCCC1 MCULE-6144532155 [0,1,0,1,0,0|2,0,0]=4 4075 B7R1.1 C=CC1CCNC1 MCULE-7703785367 [0,1,0,1,0,0|2,0,0]=4 4076 B7R1.1 CCC1=CCCC1 MCULE-5154730597 [0,1,0,1,0,0|2,0,0]=4 4077 B7R1.1 CCC1=NCCN1 MCULE-4105881010 [0,1,0,1,0,0|2,0,0]=4 4078 B7R1.1 CCC1=NCCO1 MCULE-3838550511 [0,1,0,1,0,0|1,0,0]=3 4079 B7R1.1 CCC1CCCC1 MCULE-1974854934 [0,1,0,1,0,0|2,0,0]=4 4080 B7R1.1 CCC1CCCN1 MCULE-1775351089 [0,1,0,1,0,0|2,0,0]=4 4081 B7R1.1 CCC1CCCN1 MCULE-2065682250 [0,1,0,1,0,0|2,0,0]=4 4082 B7R1.1 CCC1CCCN1 MCULE-8326168982 [0,1,0,1,0,0|2,0,0]=4 4083 B7R1.1 CCC1CCCN1 MCULE-9831560442 [0,1,0,1,0,0|2,0,0]=4 4084 B7R1.1 CCC1CCNC1 MCULE-1558031098 [0,1,0,1,0,0|2,0,0]=4 4085 B7R1.1 CCC1CCNC1 MCULE-1877930466 [0,1,0,1,0,0|2,0,0]=4 4086 B7R1.1 CCC1OCCO1 MCULE-3434568584 [0,1,0,1,0,0|0,0,0]=2 4087 B7R1.1 CCN1CCCC1 MCULE-3590039255 [0,1,0,1,0,0|2,0,0]=4 4088 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [0,1,0,1,0,0|2,0,0]=4 4089 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [0,1,0,1,0,0|2,0,0]=4 4090 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [0,1,0,1,0,0|2,0,0]=4 4091 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [0,1,0,1,0,0|2,0,0]=4 4092 B7R1.1 CC[C@@H]1CCNC1 MCULE-1468303255 [0,1,0,1,0,0|2,0,0]=4 4093 B7R1.1 CC[C@@H]1CCNC1 MCULE-2434021547 [0,1,0,1,0,0|2,0,0]=4 4094 B7R1.1 CC[C@@H]1CCNC1 MCULE-4288710106 [0,1,0,1,0,0|2,0,0]=4 4095 B7R1.1 CC[C@@H]1CCNC1 MCULE-5295271815 [0,1,0,1,0,0|2,0,0]=4 4096 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [0,1,0,1,0,0|2,0,0]=4 4097 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [0,1,0,1,0,0|2,0,0]=4 4098 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [0,1,0,1,0,0|2,0,0]=4 4099 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [0,1,0,1,0,0|2,0,0]=4 4100 B7R1.1 CC[C@H]1CCNC1 MCULE-5122116015 [0,1,0,1,0,0|2,0,0]=4 4101 B7R1.1 CC[C@H]1CCNC1 MCULE-5302237772 [0,1,0,1,0,0|2,0,0]=4 4102 B7R1.1 CC[C@H]1CCNC1 MCULE-9447387540 [0,1,0,1,0,0|2,0,0]=4 4103 B7R1.1 CC[C@H]1CCNC1 MCULE-9743799071 [0,1,0,1,0,0|2,0,0]=4 4104 B7R1.1 CNC1CCCC1 MCULE-1391832163 [0,1,0,1,0,0|2,0,0]=4 4105 B7R1.1 CNC1CCCC1 MCULE-8242451793 [0,1,0,1,0,0|2,0,0]=4 4106 B7R1.1 CNC1CCNC1 MCULE-5544853841 [0,1,0,1,0,0|2,0,0]=4 4107 B7R1.1 CNC1CCNC1 MCULE-9402107922 [0,1,0,1,0,0|2,0,0]=4 4108 B7R1.1 CNC1CCOC1 MCULE-5628928593 [0,1,0,1,0,0|1,0,0]=3 4109 B7R1.1 CNC1CCOC1 MCULE-7465078745 [0,1,0,1,0,0|1,0,0]=3 4110 B7R1.1 CNC1CCOC1 MCULE-8928979869 [0,1,0,1,0,0|1,0,0]=3 4111 B7R1.1 CNC1CCSC1 MCULE-1603222229 [0,1,0,1,0,0|1,1,0]=4 4112 B7R1.1 CNC1CCSC1 MCULE-5376977039 [0,1,0,1,0,0|1,1,0]=4 4113 B7R1.1 CNC1CCSC1 MCULE-9789640029 [0,1,0,1,0,0|1,1,0]=4 4114 B7R1.1 CN[C@@H]1CCNC1 MCULE-1090651309 [0,1,0,1,0,0|2,0,0]=4 4115 B7R1.1 CN[C@@H]1CCNC1 MCULE-6088625234 [0,1,0,1,0,0|2,0,0]=4 4116 B7R1.1 CN[C@@H]1CCNC1 MCULE-8530771803 [0,1,0,1,0,0|2,0,0]=4 4117 B7R1.1 CN[C@@H]1CCNC1 MCULE-9769572717 [0,1,0,1,0,0|2,0,0]=4 4118 B7R1.1 CN[C@@H]1CCOC1 MCULE-2275496757 [0,1,0,1,0,0|1,0,0]=3 4119 B7R1.1 CN[C@@H]1CCOC1 MCULE-4479731635 [0,1,0,1,0,0|1,0,0]=3 4120 B7R1.1 CN[C@@H]1CCOC1 MCULE-4936509842 [0,1,0,1,0,0|1,0,0]=3 4121 B7R1.1 CN[C@@H]1CCOC1 MCULE-7543653230 [0,1,0,1,0,0|1,0,0]=3 4122 B7R1.1 CN[C@H]1CCNC1 MCULE-3142856248 [0,1,0,1,0,0|2,0,0]=4 4123 B7R1.1 CN[C@H]1CCNC1 MCULE-7615640017 [0,1,0,1,0,0|2,0,0]=4 4124 B7R1.1 CN[C@H]1CCNC1 MCULE-9192229718 [0,1,0,1,0,0|2,0,0]=4 4125 B7R1.1 CN[C@H]1CCOC1 MCULE-3884907072 [0,1,0,1,0,0|1,0,0]=3 4126 B7R1.1 CN[C@H]1CCOC1 MCULE-5671082057 [0,1,0,1,0,0|1,0,0]=3 4127 B7R1.1 CN[C@H]1CCOC1 MCULE-7223789451 [0,1,0,1,0,0|1,0,0]=3 4128 B7R1.1 CN[C@H]1CCOC1 MCULE-7903690510 [0,1,0,1,0,0|1,0,0]=3 4129 B7R1.1 COC1CC=CC1 MCULE-3537302351 [0,1,0,1,0,0|1,0,1]=4 4130 B7R1.1 COC1CCCC1 MCULE-7539347010 [0,1,0,1,0,0|1,0,0]=3 4131 B7R1.1 COC1CCCO1 MCULE-8363423240 [0,1,0,1,0,0|1,0,0]=3 4132 B7R1.1 COC1CCNC1 MCULE-1194889067 [0,1,0,1,0,0|1,0,0]=3 4133 B7R1.1 COC1CCNC1 MCULE-2551543855 [0,1,0,1,0,0|1,0,0]=3 4134 B7R1.1 COC1CNOC1 MCULE-1407072401 [0,1,0,1,0,0|1,0,0]=3 4135 B7R1.1 COC1CNOC1 MCULE-3670243548 [0,1,0,1,0,0|1,0,0]=3 4136 B7R1.1 COC1OCCO1 MCULE-9935127218 [0,1,0,1,0,0|0,0,0]=2 4137 B7R1.1 CO[C@@H]1CCNC1 MCULE-1457133388 [0,1,0,1,0,0|1,0,0]=3 4138 B7R1.1 CO[C@@H]1CCNC1 MCULE-5592053485 [0,1,0,1,0,0|1,0,0]=3 4139 B7R1.1 CO[C@@H]1CCNC1 MCULE-9586958523 [0,1,0,1,0,0|1,0,0]=3 4140 B7R1.1 CO[C@@H]1CCNC1 MCULE-9627985971 [0,1,0,1,0,0|1,0,0]=3 4141 B7R1.1 CO[C@H]1CCNC1 MCULE-4011037765 [0,1,0,1,0,0|1,0,0]=3 4142 B7R1.1 CO[C@H]1CCNC1 MCULE-6371005292 [0,1,0,1,0,0|1,0,0]=3 4143 B7R1.1 CO[C@H]1CCNC1 MCULE-6820243921 [0,1,0,1,0,0|1,0,0]=3 4144 B7R1.1 CO[C@H]1CCNC1 MCULE-9345557765 [0,1,0,1,0,0|1,0,0]=3 4145 B7R1.1 CSC1CCNC1 MCULE-8160363271 [0,1,0,1,0,0|1,1,0]=4 4146 B7R1.1 CSC1CCNC1 MCULE-8993526132 [0,1,0,1,0,0|1,1,0]=4 4147 B7R1.1 CS[C@@H]1CCNC1 MCULE-5068595479 [0,1,0,1,0,0|1,1,0]=4 4148 B7R1.1 CS[C@@H]1CCNC1 MCULE-7615711516 [0,1,0,1,0,0|1,1,0]=4 4149 B7R1.1 CS[C@@H]1CCNC1 MCULE-8265640185 [0,1,0,1,0,0|1,1,0]=4 4150 B7R1.1 CS[C@@H]1CCNC1 MCULE-9548332479 [0,1,0,1,0,0|1,1,0]=4 4151 B7R1.1 ClCC1=NCCO1 MCULE-8789331570 [0,1,0,1,0,0|1,0,1]=4 4152 B7R1.1 ClCC1=NOCC1 MCULE-8714304275 [0,1,0,1,0,0|1,0,1]=4 4153 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [0,1,0,1,0,0|2,0,0]=4 4154 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [0,1,0,1,0,0|2,0,0]=4 4155 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [0,1,0,1,0,0|2,0,0]=4 4156 B7R1.1 ClCC1CCCO1 MCULE-9816764842 [0,1,0,1,0,0|1,0,0]=3 4157 B7R1.1 ClCC1CCNC1 MCULE-3647066500 [0,1,0,1,0,0|2,0,0]=4 4158 B7R1.1 ClCC1CCNC1 MCULE-4046034551 [0,1,0,1,0,0|2,0,0]=4 4159 B7R1.1 ClCC1CCOC1 MCULE-1203835826 [0,1,0,1,0,0|1,0,0]=3 4160 B7R1.1 ClCC1OCCO1 MCULE-2722734837 [0,1,0,1,0,0|0,0,0]=2 4161 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [0,1,0,1,0,0|2,0,0]=4 4162 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [0,1,0,1,0,0|2,0,0]=4 4163 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [0,1,0,1,0,0|2,0,0]=4 4164 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [0,1,0,1,0,0|2,0,0]=4 4165 B7R1.1 ClC[C@@H]1CCNC1 MCULE-3561633948 [0,1,0,1,0,0|2,0,0]=4 4166 B7R1.1 ClC[C@@H]1CCNC1 MCULE-9146547190 [0,1,0,1,0,0|2,0,0]=4 4167 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [0,1,0,1,0,0|2,0,0]=4 4168 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [0,1,0,1,0,0|2,0,0]=4 4169 B7R1.1 ClC[C@H]1CCNC1 MCULE-1113644310 [0,1,0,1,0,0|2,0,0]=4 4170 B7R1.1 ClC[C@H]1CCNC1 MCULE-4950070763 [0,1,0,1,0,0|2,0,0]=4 4171 B7R1.1 FCC1CCCN1 MCULE-3216030316 [0,1,0,1,0,0|2,0,0]=4 4172 B7R1.1 FCC1CCCN1 MCULE-4540803550 [0,1,0,1,0,0|2,0,0]=4 4173 B7R1.1 FCC1CCNC1 MCULE-1978414491 [0,1,0,1,0,0|2,0,0]=4 4174 B7R1.1 FCC1CCNC1 MCULE-5950087621 [0,1,0,1,0,0|2,0,0]=4 4175 B7R1.1 FCC1CCNC1 MCULE-7750703127 [0,1,0,1,0,0|2,0,0]=4 4176 B7R1.1 FCC1CCNC1 MCULE-8603606998 [0,1,0,1,0,0|2,0,0]=4 4177 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [0,1,0,1,0,0|2,0,0]=4 4178 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [0,1,0,1,0,0|2,0,0]=4 4179 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [0,1,0,1,0,0|2,0,0]=4 4180 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [0,1,0,1,0,0|2,0,0]=4 4181 B7R1.1 FC[C@@H]1CCNC1 MCULE-2159002313 [0,1,0,1,0,0|2,0,0]=4 4182 B7R1.1 FC[C@@H]1CCNC1 MCULE-4712597711 [0,1,0,1,0,0|2,0,0]=4 4183 B7R1.1 FC[C@@H]1CCNC1 MCULE-6166975534 [0,1,0,1,0,0|2,0,0]=4 4184 B7R1.1 FC[C@@H]1CCNC1 MCULE-7608233986 [0,1,0,1,0,0|2,0,0]=4 4185 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [0,1,0,1,0,0|2,0,0]=4 4186 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [0,1,0,1,0,0|2,0,0]=4 4187 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [0,1,0,1,0,0|2,0,0]=4 4188 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [0,1,0,1,0,0|2,0,0]=4 4189 B7R1.1 FC[C@H]1CCNC1 MCULE-2828011524 [0,1,0,1,0,0|2,0,0]=4 4190 B7R1.1 FC[C@H]1CCNC1 MCULE-4192540640 [0,1,0,1,0,0|2,0,0]=4 4191 B7R1.1 FC[C@H]1CCNC1 MCULE-5280605995 [0,1,0,1,0,0|2,0,0]=4 4192 B7R1.1 FC[C@H]1CCNC1 MCULE-8886310417 [0,1,0,1,0,0|2,0,0]=4 4193 B7R1.1 ICC1CCCC1 MCULE-5940886897 [0,1,0,1,0,0|2,0,0]=4 4194 B7R1.1 ICC1CCCN1 MCULE-3467617934 [0,1,0,1,0,0|2,0,0]=4 4195 B7R1.1 ICC1CCCN1 MCULE-7784862806 [0,1,0,1,0,0|2,0,0]=4 4196 B7R1.1 ICC1CCCO1 MCULE-3981288245 [0,1,0,1,0,0|1,0,0]=3 4197 B7R1.1 ICC1CCNC1 MCULE-4259439945 [0,1,0,1,0,0|2,0,0]=4 4198 B7R1.1 ICC1CCNC1 MCULE-6061564929 [0,1,0,1,0,0|2,0,0]=4 4199 B7R1.1 ICC1CCOC1 MCULE-2014671156 [0,1,0,1,0,0|1,0,0]=3 4200 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [0,1,0,1,0,0|2,0,0]=4 4201 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [0,1,0,1,0,0|2,0,0]=4 4202 B7R1.1 IC[C@H]1CCOC1 MCULE-5163407500 [0,1,0,1,0,0|1,0,0]=3 4203 B7R1.1 N#CC1CCCC1 MCULE-1484517612 [0,1,0,1,0,0|2,0,0]=4 4204 B7R1.1 N#CC1CCCO1 MCULE-6657753631 [0,1,0,1,0,0|1,0,1]=4 4205 B7R1.1 N#CC1CCNC1 MCULE-2090722666 [0,1,0,1,0,0|2,0,0]=4 4206 B7R1.1 N#CC1CCNC1 MCULE-3197404572 [0,1,0,1,0,0|2,0,0]=4 4207 B7R1.1 N#CC1CCNC1 MCULE-4677394011 [0,1,0,1,0,0|2,0,0]=4 4208 B7R1.1 N#CC1CCNC1 MCULE-7538071104 [0,1,0,1,0,0|2,0,0]=4 4209 B7R1.1 N#CC1CCOC1 MCULE-5555423051 [0,1,0,1,0,0|1,0,0]=3 4210 B7R1.1 N#CC1CCSC1 MCULE-6188837269 [0,1,0,1,0,0|1,1,0]=4 4211 B7R1.1 N#C[C@@H]1CCNC1 MCULE-3834395129 [0,1,0,1,0,0|2,0,0]=4 4212 B7R1.1 N#C[C@@H]1CCNC1 MCULE-5148825522 [0,1,0,1,0,0|2,0,0]=4 4213 B7R1.1 N#C[C@@H]1CCNC1 MCULE-6307308537 [0,1,0,1,0,0|2,0,0]=4 4214 B7R1.1 N#C[C@@H]1CCNC1 MCULE-6821015295 [0,1,0,1,0,0|2,0,0]=4 4215 B7R1.1 N#C[C@@H]1CCOC1 MCULE-4697885787 [0,1,0,1,0,0|1,0,0]=3 4216 B7R1.1 N#C[C@@H]1CCOC1 MCULE-7073460204 [0,1,0,1,0,0|1,0,0]=3 4217 B7R1.1 N#C[C@H]1CCNC1 MCULE-2994856177 [0,1,0,1,0,0|2,0,0]=4 4218 B7R1.1 N#C[C@H]1CCNC1 MCULE-4920099746 [0,1,0,1,0,0|2,0,0]=4 4219 B7R1.1 N#C[C@H]1CCNC1 MCULE-6338524969 [0,1,0,1,0,0|2,0,0]=4 4220 B7R1.1 N#C[C@H]1CCNC1 MCULE-8239077200 [0,1,0,1,0,0|2,0,0]=4 4221 B7R1.1 N#C[C@H]1CCOC1 MCULE-6745266026 [0,1,0,1,0,0|1,0,0]=3 4222 B7R1.1 N#C[C@H]1CCOC1 MCULE-6946151061 [0,1,0,1,0,0|1,0,0]=3 4223 B7R1.1 NCC1C=CCC1 MCULE-5829076156 [0,1,0,1,0,0|2,0,0]=4 4224 B7R1.1 NCC1C=CCC1 MCULE-8381701177 [0,1,0,1,0,0|2,0,0]=4 4225 B7R1.1 NCC1CCCC1 MCULE-3629796849 [0,1,0,1,0,0|2,0,0]=4 4226 B7R1.1 NCC1CCCC1 MCULE-8453900433 [0,1,0,1,0,0|2,0,0]=4 4227 B7R1.1 NCC1CCCN1 MCULE-4764684364 [0,1,0,1,0,0|2,0,0]=4 4228 B7R1.1 NCC1CCCN1 MCULE-8971980286 [0,1,0,1,0,0|2,0,0]=4 4229 B7R1.1 NCC1CCCO1 MCULE-2797516262 [0,1,0,1,0,0|1,0,0]=3 4230 B7R1.1 NCC1CCCO1 MCULE-5970677903 [0,1,0,1,0,0|1,0,0]=3 4231 B7R1.1 NCC1CCCO1 MCULE-6166235034 [0,1,0,1,0,0|1,0,0]=3 4232 B7R1.1 NCC1CCCS1 MCULE-5278325816 [0,1,0,1,0,0|1,1,0]=4 4233 B7R1.1 NCC1CCNC1 MCULE-1458513231 [0,1,0,1,0,0|2,0,0]=4 4234 B7R1.1 NCC1CCNC1 MCULE-3817893631 [0,1,0,1,0,0|2,0,0]=4 4235 B7R1.1 NCC1CCOC1 MCULE-4208746127 [0,1,0,1,0,0|1,0,0]=3 4236 B7R1.1 NCC1CCOC1 MCULE-6540410947 [0,1,0,1,0,0|1,0,0]=3 4237 B7R1.1 NCC1CCSC1 MCULE-6868901477 [0,1,0,1,0,0|1,1,0]=4 4238 B7R1.1 NCC1COCO1 MCULE-1657884847 [0,1,0,1,0,0|1,0,0]=3 4239 B7R1.1 NCC1COCO1 MCULE-9310217083 [0,1,0,1,0,0|1,0,0]=3 4240 B7R1.1 NCC1OCCO1 MCULE-4813269641 [0,1,0,1,0,0|0,0,0]=2 4241 B7R1.1 NCC1SCCS1 MCULE-1964630168 [0,1,0,1,0,0|0,2,0]=4 4242 B7R1.1 NCC1SCCS1 MCULE-6937478627 [0,1,0,1,0,0|0,2,0]=4 4243 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [0,1,0,1,0,0|2,0,0]=4 4244 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [0,1,0,1,0,0|2,0,0]=4 4245 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [0,1,0,1,0,0|2,0,0]=4 4246 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [0,1,0,1,0,0|2,0,0]=4 4247 B7R1.1 NC[C@@H]1CCCO1 MCULE-1103643839 [0,1,0,1,0,0|1,0,0]=3 4248 B7R1.1 NC[C@@H]1CCCO1 MCULE-1402571993 [0,1,0,1,0,0|1,0,0]=3 4249 B7R1.1 NC[C@@H]1CCCO1 MCULE-1448381041 [0,1,0,1,0,0|1,0,0]=3 4250 B7R1.1 NC[C@@H]1CCCO1 MCULE-6664501749 [0,1,0,1,0,0|1,0,0]=3 4251 B7R1.1 NC[C@@H]1CCOC1 MCULE-2941934022 [0,1,0,1,0,0|1,0,0]=3 4252 B7R1.1 NC[C@@H]1CCOC1 MCULE-2981279377 [0,1,0,1,0,0|1,0,0]=3 4253 B7R1.1 NC[C@@H]1CCOC1 MCULE-6671508282 [0,1,0,1,0,0|1,0,0]=3 4254 B7R1.1 NC[C@@H]1CCOC1 MCULE-7170580817 [0,1,0,1,0,0|1,0,0]=3 4255 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [0,1,0,1,0,0|2,0,0]=4 4256 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [0,1,0,1,0,0|2,0,0]=4 4257 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [0,1,0,1,0,0|2,0,0]=4 4258 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [0,1,0,1,0,0|2,0,0]=4 4259 B7R1.1 NC[C@H]1CCCO1 MCULE-1196018690 [0,1,0,1,0,0|1,0,0]=3 4260 B7R1.1 NC[C@H]1CCCO1 MCULE-2037746017 [0,1,0,1,0,0|1,0,0]=3 4261 B7R1.1 NC[C@H]1CCCO1 MCULE-3470426685 [0,1,0,1,0,0|1,0,0]=3 4262 B7R1.1 NC[C@H]1CCCO1 MCULE-9918683284 [0,1,0,1,0,0|1,0,0]=3 4263 B7R1.1 NC[C@H]1CCOC1 MCULE-1537228220 [0,1,0,1,0,0|1,0,0]=3 4264 B7R1.1 NC[C@H]1CCOC1 MCULE-2673094483 [0,1,0,1,0,0|1,0,0]=3 4265 B7R1.1 NC[C@H]1CCOC1 MCULE-4873739830 [0,1,0,1,0,0|1,0,0]=3 4266 B7R1.1 NC[C@H]1CCOC1 MCULE-6059527282 [0,1,0,1,0,0|1,0,0]=3 4267 B7R1.1 NNC1CCCC1 MCULE-1363058529 [0,1,0,1,0,0|2,0,0]=4 4268 B7R1.1 NNC1CCCC1 MCULE-2803402819 [0,1,0,1,0,0|2,0,0]=4 4269 B7R1.1 NNC1CCCC1 MCULE-5556380186 [0,1,0,1,0,0|2,0,0]=4 4270 B7R1.1 NNC1CCNC1 MCULE-2142578337 [0,1,0,1,0,0|2,0,0]=4 4271 B7R1.1 NNC1CCNC1 MCULE-9229134321 [0,1,0,1,0,0|2,0,0]=4 4272 B7R1.1 NNC1CCOC1 MCULE-5497635104 [0,1,0,1,0,0|1,0,0]=3 4273 B7R1.1 NNC1CCOC1 MCULE-9086625827 [0,1,0,1,0,0|1,0,0]=3 4274 B7R1.1 NNC1CCOC1 MCULE-9696991785 [0,1,0,1,0,0|1,0,0]=3 4275 B7R1.1 NNC1CCSC1 MCULE-2826177760 [0,1,0,1,0,0|1,1,0]=4 4276 B7R1.1 NNC1CCSC1 MCULE-3433599716 [0,1,0,1,0,0|1,1,0]=4 4277 B7R1.1 NN[C@@H]1CCOC1 MCULE-5277138269 [0,1,0,1,0,0|1,0,0]=3 4278 B7R1.1 NN[C@@H]1CCOC1 MCULE-5921785384 [0,1,0,1,0,0|1,0,0]=3 4279 B7R1.1 NN[C@@H]1CCOC1 MCULE-7398479477 [0,1,0,1,0,0|1,0,0]=3 4280 B7R1.1 NN[C@@H]1CCOC1 MCULE-9971593238 [0,1,0,1,0,0|1,0,0]=3 4281 B7R1.1 NN[C@H]1CCOC1 MCULE-2032105408 [0,1,0,1,0,0|1,0,0]=3 4282 B7R1.1 NN[C@H]1CCOC1 MCULE-4857620237 [0,1,0,1,0,0|1,0,0]=3 4283 B7R1.1 NN[C@H]1CCOC1 MCULE-5796183363 [0,1,0,1,0,0|1,0,0]=3 4284 B7R1.1 NN[C@H]1CCOC1 MCULE-8921088992 [0,1,0,1,0,0|1,0,0]=3 4285 B7R1.1 NOC1CCCC1 MCULE-1504814106 [0,1,0,1,0,0|1,0,0]=3 4286 B7R1.1 NOC1CCCC1 MCULE-1973418119 [0,1,0,1,0,0|1,0,0]=3 4287 B7R1.1 NOC1CCOC1 MCULE-1016688849 [0,1,0,1,0,0|0,0,0]=2 4288 B7R1.1 O=CC1CCCC1 MCULE-4938681495 [0,1,0,1,0,0|1,0,1]=4 4289 B7R1.1 O=CC1CCCO1 MCULE-4587605451 [0,1,0,1,0,0|0,0,2]=4 4290 B7R1.1 O=CC1CCNC1 MCULE-5188223111 [0,1,0,1,0,0|1,0,1]=4 4291 B7R1.1 O=CC1CCOC1 MCULE-9515567606 [0,1,0,1,0,0|0,0,1]=3 4292 B7R1.1 O=CC1CCSC1 MCULE-1282848613 [0,1,0,1,0,0|0,1,1]=4 4293 B7R1.1 O=C[C@@H]1CCOC1 MCULE-5181257964 [0,1,0,1,0,0|0,0,1]=3 4294 B7R1.1 O=C[C@H]1CCOC1 MCULE-4532427366 [0,1,0,1,0,0|0,0,1]=3 4295 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [0,1,0,1,0,0|1,0,1]=4 4296 B7R1.1 OCC1=NCCO1 MCULE-9432593363 [0,1,0,1,0,0|0,0,1]=3 4297 B7R1.1 OCC1C=CCC1 MCULE-1237002603 [0,1,0,1,0,0|1,0,0]=3 4298 B7R1.1 OCC1C=CCN1 MCULE-1461746159 [0,1,0,1,0,0|1,0,1]=4 4299 B7R1.1 OCC1C=CCN1 MCULE-5814337815 [0,1,0,1,0,0|1,0,1]=4 4300 B7R1.1 OCC1CC=CC1 MCULE-4213030098 [0,1,0,1,0,0|1,0,1]=4 4301 B7R1.1 OCC1CCCC1 MCULE-2985338933 [0,1,0,1,0,0|1,0,0]=3 4302 B7R1.1 OCC1CCCN1 MCULE-1016922679 [0,1,0,1,0,0|1,0,0]=3 4303 B7R1.1 OCC1CCCN1 MCULE-8224535891 [0,1,0,1,0,0|1,0,0]=3 4304 B7R1.1 OCC1CCCO1 MCULE-5877114547 [0,1,0,1,0,0|0,0,0]=2 4305 B7R1.1 OCC1CCCO1 MCULE-5884880244 [0,1,0,1,0,0|0,0,0]=2 4306 B7R1.1 OCC1CCCS1 MCULE-6106081414 [0,1,0,1,0,0|0,1,0]=3 4307 B7R1.1 OCC1CCNC1 MCULE-7883947611 [0,1,0,1,0,0|1,0,0]=3 4308 B7R1.1 OCC1CCNC1 MCULE-9689521155 [0,1,0,1,0,0|1,0,0]=3 4309 B7R1.1 OCC1CCOC1 MCULE-8926405046 [0,1,0,1,0,0|0,0,0]=2 4310 B7R1.1 OCC1CCON1 MCULE-1199975481 [0,1,0,1,0,0|0,0,0]=2 4311 B7R1.1 OCC1CCON1 MCULE-4772487016 [0,1,0,1,0,0|0,0,0]=2 4312 B7R1.1 OCC1CCSC1 MCULE-2226132734 [0,1,0,1,0,0|0,1,0]=3 4313 B7R1.1 OCC1COCO1 MCULE-3470022742 [0,1,0,1,0,0|0,0,0]=2 4314 B7R1.1 OCC1OCCO1 MCULE-8334027179 [0,1,0,1,0,0|0,0,0]=2 4315 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [0,1,0,1,0,0|1,0,0]=3 4316 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [0,1,0,1,0,0|1,0,0]=3 4317 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [0,1,0,1,0,0|1,0,0]=3 4318 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [0,1,0,1,0,0|1,0,0]=3 4319 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [0,1,0,1,0,0|0,0,0]=2 4320 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [0,1,0,1,0,0|0,0,0]=2 4321 B7R1.1 OC[C@@H]1CCNC1 MCULE-3126404140 [0,1,0,1,0,0|1,0,0]=3 4322 B7R1.1 OC[C@@H]1CCNC1 MCULE-4876549629 [0,1,0,1,0,0|1,0,0]=3 4323 B7R1.1 OC[C@@H]1CCNC1 MCULE-7050415145 [0,1,0,1,0,0|1,0,0]=3 4324 B7R1.1 OC[C@@H]1CCNC1 MCULE-8785146407 [0,1,0,1,0,0|1,0,0]=3 4325 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [0,1,0,1,0,0|0,0,0]=2 4326 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [0,1,0,1,0,0|0,0,0]=2 4327 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [0,1,0,1,0,0|1,0,0]=3 4328 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [0,1,0,1,0,0|1,0,0]=3 4329 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [0,1,0,1,0,0|1,0,0]=3 4330 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [0,1,0,1,0,0|1,0,0]=3 4331 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [0,1,0,1,0,0|0,0,0]=2 4332 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [0,1,0,1,0,0|0,0,0]=2 4333 B7R1.1 OC[C@H]1CCNC1 MCULE-3909770597 [0,1,0,1,0,0|1,0,0]=3 4334 B7R1.1 OC[C@H]1CCNC1 MCULE-5006682123 [0,1,0,1,0,0|1,0,0]=3 4335 B7R1.1 OC[C@H]1CCNC1 MCULE-8265382423 [0,1,0,1,0,0|1,0,0]=3 4336 B7R1.1 OC[C@H]1CCNC1 MCULE-8371969680 [0,1,0,1,0,0|1,0,0]=3 4337 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [0,1,0,1,0,0|0,0,0]=2 4338 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [0,1,0,1,0,0|0,0,0]=2 4339 B7R1.1 ON=C1CCCC1 MCULE-9338449832 [0,1,0,1,0,0|1,0,1]=4 4340 B7R1.1 ONC1CCCC1 MCULE-1143510043 [0,1,0,1,0,0|1,0,0]=3 4341 B7R1.1 ONC1CCCC1 MCULE-7548854169 [0,1,0,1,0,0|1,0,0]=3 4342 B7R1.1 SCC1CCCC1 MCULE-7973872166 [0,1,0,1,0,0|1,1,0]=4 4343 B7R1.1 SCC1CCCO1 MCULE-5962232488 [0,1,0,1,0,0|0,1,0]=3 4344 B7R1.1 SCC1CCOC1 MCULE-4504314486 [0,1,0,1,0,0|0,1,0]=3 4345 B7R1.2 C1(CCN(C1)C)N MCULE-3665102712 [0,1,0,1,0,0|2,0,0]=4 4346 B7R1.2 C1(CCN(C1)C)O MCULE-5142099784 [0,1,0,1,0,0|1,0,0]=3 4347 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [0,1,0,1,0,0|1,0,1]=4 4348 B7R1.2 CC1=NC(CO1)C MCULE-2489340707 [0,1,0,1,0,0|1,0,1]=4 4349 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,1,0,1,0,0|0,0,2]=4 4350 B7R1.2 CC1CC(CN1)F MCULE-5211772527 [0,1,0,1,0,0|2,0,0]=4 4351 B7R1.2 CC1CC(CN1)F MCULE-6845898511 [0,1,0,1,0,0|2,0,0]=4 4352 B7R1.2 CC1CC(CN1)O MCULE-5630063862 [0,1,0,1,0,0|1,0,0]=3 4353 B7R1.2 CC1CC(CN1)O MCULE-7427731937 [0,1,0,1,0,0|1,0,0]=3 4354 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [0,1,0,1,0,0|1,0,0]=3 4355 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [0,1,0,1,0,0|1,0,0]=3 4356 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [0,1,0,1,0,0|0,0,0]=2 4357 B7R1.2 CC1CC(CS1)N MCULE-2886562999 [0,1,0,1,0,0|1,1,0]=4 4358 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,1,0,1,0,0|2,0,0]=4 4359 B7R1.2 CC1CCC(=O)O1 MCULE-3014789527 [0,1,0,1,0,0|1,0,1]=4 4360 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [0,1,0,1,0,0|2,0,0]=4 4361 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [0,1,0,1,0,0|2,0,0]=4 4362 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [0,1,0,1,0,0|2,0,0]=4 4363 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [0,1,0,1,0,0|2,0,0]=4 4364 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [0,1,0,1,0,0|1,0,0]=3 4365 B7R1.2 CC1CCC(N1)C MCULE-8652550641 [0,1,0,1,0,0|2,0,0]=4 4366 B7R1.2 CC1CCC(N1)C MCULE-9945795318 [0,1,0,1,0,0|2,0,0]=4 4367 B7R1.2 CC1CCC(O1)C MCULE-6766843462 [0,1,0,1,0,0|1,0,0]=3 4368 B7R1.2 CC1CC[C@H](N1)C MCULE-7537248866 [0,1,0,1,0,0|2,0,0]=4 4369 B7R1.2 CC1CC[C@H](N1)C MCULE-8839413924 [0,1,0,1,0,0|2,0,0]=4 4370 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [0,1,0,1,0,0|2,0,0]=4 4371 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [0,1,0,1,0,0|2,0,0]=4 4372 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [0,1,0,1,0,0|1,0,1]=4 4373 B7R1.2 CC1COC(=O)O1 MCULE-9055336051 [0,1,0,1,0,0|1,0,1]=4 4374 B7R1.2 CC1COC(O1)C MCULE-5670718739 [0,1,0,1,0,0|0,0,0]=2 4375 B7R1.2 CC1COS(=O)O1 MCULE-7795249539 [0,1,0,1,0,0|2,0,0]=4 4376 B7R1.2 CN1CCC(C1)Br MCULE-3493698258 [0,1,0,1,0,0|2,0,0]=4 4377 B7R1.2 CN1CCC(C1)Cl MCULE-4289154186 [0,1,0,1,0,0|2,0,0]=4 4378 B7R1.2 CN1CCC(C1)I MCULE-7694112270 [0,1,0,1,0,0|2,0,0]=4 4379 B7R1.2 CN1CCC(C1)N MCULE-1293214424 [0,1,0,1,0,0|2,0,0]=4 4380 B7R1.2 CN1CCC(C1)N MCULE-1923071969 [0,1,0,1,0,0|2,0,0]=4 4381 B7R1.2 CN1CCC(C1)N MCULE-8906644208 [0,1,0,1,0,0|2,0,0]=4 4382 B7R1.2 CN1CCC(C1)O MCULE-7899934177 [0,1,0,1,0,0|1,0,0]=3 4383 B7R1.2 CN1CC[C@@H](C1)Br MCULE-3557435415 [0,1,0,1,0,0|2,0,0]=4 4384 B7R1.2 CN1CC[C@@H](C1)Cl MCULE-2590203116 [0,1,0,1,0,0|2,0,0]=4 4385 B7R1.2 CN1CC[C@@H](C1)I MCULE-9659903055 [0,1,0,1,0,0|2,0,0]=4 4386 B7R1.2 CN1CC[C@@H](C1)N MCULE-2789588017 [0,1,0,1,0,0|2,0,0]=4 4387 B7R1.2 CN1CC[C@@H](C1)N MCULE-3064746432 [0,1,0,1,0,0|2,0,0]=4 4388 B7R1.2 CN1CC[C@@H](C1)N MCULE-3417580502 [0,1,0,1,0,0|2,0,0]=4 4389 B7R1.2 CN1CC[C@@H](C1)N MCULE-4507441839 [0,1,0,1,0,0|2,0,0]=4 4390 B7R1.2 CN1CC[C@@H](C1)N MCULE-7304925156 [0,1,0,1,0,0|2,0,0]=4 4391 B7R1.2 CN1CC[C@@H](C1)N MCULE-8752975101 [0,1,0,1,0,0|2,0,0]=4 4392 B7R1.2 CN1CC[C@@H](C1)O MCULE-1236945758 [0,1,0,1,0,0|1,0,0]=3 4393 B7R1.2 CN1CC[C@@H](C1)O MCULE-4275527304 [0,1,0,1,0,0|1,0,0]=3 4394 B7R1.2 CN1CC[C@H](C1)Br MCULE-5126641770 [0,1,0,1,0,0|2,0,0]=4 4395 B7R1.2 CN1CC[C@H](C1)Cl MCULE-6900681925 [0,1,0,1,0,0|2,0,0]=4 4396 B7R1.2 CN1CC[C@H](C1)I MCULE-5536628497 [0,1,0,1,0,0|2,0,0]=4 4397 B7R1.2 CN1CC[C@H](C1)N MCULE-1557911450 [0,1,0,1,0,0|2,0,0]=4 4398 B7R1.2 CN1CC[C@H](C1)N MCULE-2070741351 [0,1,0,1,0,0|2,0,0]=4 4399 B7R1.2 CN1CC[C@H](C1)N MCULE-4287469497 [0,1,0,1,0,0|2,0,0]=4 4400 B7R1.2 CN1CC[C@H](C1)N MCULE-6191225667 [0,1,0,1,0,0|2,0,0]=4 4401 B7R1.2 CN1CC[C@H](C1)N MCULE-7699833473 [0,1,0,1,0,0|2,0,0]=4 4402 B7R1.2 CN1CC[C@H](C1)N MCULE-8419212613 [0,1,0,1,0,0|2,0,0]=4 4403 B7R1.2 CN1CC[C@H](C1)O MCULE-6665002754 [0,1,0,1,0,0|1,0,0]=3 4404 B7R1.2 CN1CC[C@H](C1)O MCULE-8080661086 [0,1,0,1,0,0|1,0,0]=3 4405 B7R1.2 C[C@@H]1CCC(=O)O1 MCULE-5934008113 [0,1,0,1,0,0|1,0,1]=4 4406 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [0,1,0,1,0,0|2,0,0]=4 4407 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [0,1,0,1,0,0|2,0,0]=4 4408 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-1673197449 [0,1,0,1,0,0|2,0,0]=4 4409 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-2729648845 [0,1,0,1,0,0|2,0,0]=4 4410 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-4960548681 [0,1,0,1,0,0|2,0,0]=4 4411 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-9686295802 [0,1,0,1,0,0|2,0,0]=4 4412 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [0,1,0,1,0,0|1,0,1]=4 4413 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [0,1,0,1,0,0|1,0,1]=4 4414 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-3187800510 [0,1,0,1,0,0|1,0,1]=4 4415 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-6719271655 [0,1,0,1,0,0|1,0,1]=4 4416 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-1790804170 [0,1,0,1,0,0|2,0,0]=4 4417 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-2224321786 [0,1,0,1,0,0|2,0,0]=4 4418 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6164070045 [0,1,0,1,0,0|2,0,0]=4 4419 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6870592338 [0,1,0,1,0,0|2,0,0]=4 4420 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-1211015225 [0,1,0,1,0,0|1,0,0]=3 4421 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8025231795 [0,1,0,1,0,0|1,0,0]=3 4422 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8074184383 [0,1,0,1,0,0|1,0,0]=3 4423 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8403784233 [0,1,0,1,0,0|1,0,0]=3 4424 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-1165785658 [0,1,0,1,0,0|2,0,0]=4 4425 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-2237025386 [0,1,0,1,0,0|2,0,0]=4 4426 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-4695463101 [0,1,0,1,0,0|2,0,0]=4 4427 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-9859386988 [0,1,0,1,0,0|2,0,0]=4 4428 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-4359200896 [0,1,0,1,0,0|1,0,0]=3 4429 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-5029850022 [0,1,0,1,0,0|1,0,0]=3 4430 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8880723450 [0,1,0,1,0,0|1,0,0]=3 4431 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8966000465 [0,1,0,1,0,0|1,0,0]=3 4432 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,1,0,1,0,0|2,0,0]=4 4433 B7R1.2 C[C@H]1CCC(=O)O1 MCULE-5274272771 [0,1,0,1,0,0|1,0,1]=4 4434 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [0,1,0,1,0,0|2,0,0]=4 4435 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-4583560293 [0,1,0,1,0,0|2,0,0]=4 4436 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8297612622 [0,1,0,1,0,0|2,0,0]=4 4437 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8699883146 [0,1,0,1,0,0|2,0,0]=4 4438 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8917914682 [0,1,0,1,0,0|2,0,0]=4 4439 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [0,1,0,1,0,0|2,0,0]=4 4440 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [0,1,0,1,0,0|2,0,0]=4 4441 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-1935235769 [0,1,0,1,0,0|2,0,0]=4 4442 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-9833374653 [0,1,0,1,0,0|2,0,0]=4 4443 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [0,1,0,1,0,0|1,0,1]=4 4444 B7R1.2 C[C@H]1COC(=O)O1 MCULE-2416711374 [0,1,0,1,0,0|1,0,1]=4 4445 B7R1.2 C[C@H]1COC(=O)O1 MCULE-4223856214 [0,1,0,1,0,0|1,0,1]=4 4446 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-1742492020 [0,1,0,1,0,0|2,0,0]=4 4447 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-4690497151 [0,1,0,1,0,0|2,0,0]=4 4448 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-7372620241 [0,1,0,1,0,0|2,0,0]=4 4449 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-8319027426 [0,1,0,1,0,0|2,0,0]=4 4450 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-1346257695 [0,1,0,1,0,0|1,0,0]=3 4451 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-3035291598 [0,1,0,1,0,0|1,0,0]=3 4452 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-8611352921 [0,1,0,1,0,0|1,0,0]=3 4453 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-9413190353 [0,1,0,1,0,0|1,0,0]=3 4454 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-1099206732 [0,1,0,1,0,0|2,0,0]=4 4455 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8257992498 [0,1,0,1,0,0|2,0,0]=4 4456 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8335445065 [0,1,0,1,0,0|2,0,0]=4 4457 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-9395416229 [0,1,0,1,0,0|2,0,0]=4 4458 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-3188785695 [0,1,0,1,0,0|1,0,0]=3 4459 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-4518572489 [0,1,0,1,0,0|1,0,0]=3 4460 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-5322353871 [0,1,0,1,0,0|1,0,0]=3 4461 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-9693826142 [0,1,0,1,0,0|1,0,0]=3 4462 B7R1.2 NC1C=CC(C1)O MCULE-1250487700 [0,1,0,1,0,0|1,0,1]=4 4463 B7R1.2 NC1CCC(=O)C1 MCULE-5102535286 [0,1,0,1,0,0|2,0,0]=4 4464 B7R1.2 NC1CCC(=O)C1 MCULE-7722818264 [0,1,0,1,0,0|2,0,0]=4 4465 B7R1.2 NC1CCC(C1)F MCULE-1052463910 [0,1,0,1,0,0|2,0,0]=4 4466 B7R1.2 NC1CCC(C1)F MCULE-1362820422 [0,1,0,1,0,0|2,0,0]=4 4467 B7R1.2 NC1CCC(C1)N MCULE-7855552124 [0,1,0,1,0,0|2,0,0]=4 4468 B7R1.2 NC1CCC(C1)N MCULE-9706705284 [0,1,0,1,0,0|2,0,0]=4 4469 B7R1.2 NC1CCC(C1)O MCULE-5821071286 [0,1,0,1,0,0|1,0,0]=3 4470 B7R1.2 NC1CCC(C1)O MCULE-9391783901 [0,1,0,1,0,0|1,0,0]=3 4471 B7R1.2 NC1CCS(=O)C1 MCULE-7416029311 [0,1,0,1,0,0|1,1,0]=4 4472 B7R1.2 NC1CCS(=O)C1 MCULE-8914660363 [0,1,0,1,0,0|1,1,0]=4 4473 B7R1.2 NC1COC(=O)C1 MCULE-1027386953 [0,1,0,1,0,0|1,0,1]=4 4474 B7R1.2 NC1COC(=O)C1 MCULE-1493825051 [0,1,0,1,0,0|1,0,1]=4 4475 B7R1.2 NC1COC(=O)C1 MCULE-3118610284 [0,1,0,1,0,0|1,0,1]=4 4476 B7R1.2 NC1COC(=O)C1 MCULE-8194840985 [0,1,0,1,0,0|1,0,1]=4 4477 B7R1.2 N[C@@H]1C=C[C@@H](C1)O MCULE-3439280280 [0,1,0,1,0,0|1,0,1]=4 4478 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-1039943323 [0,1,0,1,0,0|2,0,0]=4 4479 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-3861238775 [0,1,0,1,0,0|2,0,0]=4 4480 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-4709681384 [0,1,0,1,0,0|2,0,0]=4 4481 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-2973461190 [0,1,0,1,0,0|1,0,0]=3 4482 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-5462229704 [0,1,0,1,0,0|1,0,0]=3 4483 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-6746606174 [0,1,0,1,0,0|1,0,0]=3 4484 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7196403409 [0,1,0,1,0,0|1,0,0]=3 4485 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7511735313 [0,1,0,1,0,0|1,0,0]=3 4486 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-9023897758 [0,1,0,1,0,0|1,0,0]=3 4487 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-1973308112 [0,1,0,1,0,0|2,0,0]=4 4488 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-2885294836 [0,1,0,1,0,0|2,0,0]=4 4489 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-3217124168 [0,1,0,1,0,0|2,0,0]=4 4490 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-3983968357 [0,1,0,1,0,0|2,0,0]=4 4491 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-2953432986 [0,1,0,1,0,0|2,0,0]=4 4492 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-5679004800 [0,1,0,1,0,0|2,0,0]=4 4493 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-7275989455 [0,1,0,1,0,0|2,0,0]=4 4494 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-9713633356 [0,1,0,1,0,0|2,0,0]=4 4495 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-3286276562 [0,1,0,1,0,0|1,0,0]=3 4496 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-5345953109 [0,1,0,1,0,0|1,0,0]=3 4497 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-6442703385 [0,1,0,1,0,0|1,0,0]=3 4498 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-7457197538 [0,1,0,1,0,0|1,0,0]=3 4499 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-2437548952 [0,1,0,1,0,0|1,0,1]=4 4500 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4215135536 [0,1,0,1,0,0|1,0,1]=4 4501 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4884145743 [0,1,0,1,0,0|1,0,1]=4 4502 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-9276068415 [0,1,0,1,0,0|1,0,1]=4 4503 B7R1.2 N[C@H]1C=C[C@H](C1)O MCULE-2880951702 [0,1,0,1,0,0|1,0,1]=4 4504 B7R1.2 N[C@H]1C=C[C@H](C1)O MCULE-7715311088 [0,1,0,1,0,0|1,0,1]=4 4505 B7R1.2 N[C@H]1CC[C@@H](C1)F MCULE-7847317272 [0,1,0,1,0,0|2,0,0]=4 4506 B7R1.2 N[C@H]1CC[C@@H](C1)F MCULE-8833201415 [0,1,0,1,0,0|2,0,0]=4 4507 B7R1.2 N[C@H]1CC[C@@H](C1)N MCULE-3035711729 [0,1,0,1,0,0|2,0,0]=4 4508 B7R1.2 N[C@H]1CC[C@@H](C1)N MCULE-6912512686 [0,1,0,1,0,0|2,0,0]=4 4509 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-2764158583 [0,1,0,1,0,0|1,0,0]=3 4510 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-5047569623 [0,1,0,1,0,0|1,0,0]=3 4511 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-7674066148 [0,1,0,1,0,0|1,0,0]=3 4512 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-8478778872 [0,1,0,1,0,0|1,0,0]=3 4513 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-1792150017 [0,1,0,1,0,0|2,0,0]=4 4514 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-4563758183 [0,1,0,1,0,0|2,0,0]=4 4515 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-4785441600 [0,1,0,1,0,0|2,0,0]=4 4516 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-5413630050 [0,1,0,1,0,0|2,0,0]=4 4517 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-7223746698 [0,1,0,1,0,0|2,0,0]=4 4518 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-9000616089 [0,1,0,1,0,0|2,0,0]=4 4519 B7R1.2 N[C@H]1CC[C@H](C1)N MCULE-3378648870 [0,1,0,1,0,0|2,0,0]=4 4520 B7R1.2 N[C@H]1CC[C@H](C1)N MCULE-7356571170 [0,1,0,1,0,0|2,0,0]=4 4521 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-3786824722 [0,1,0,1,0,0|1,0,0]=3 4522 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-4140170961 [0,1,0,1,0,0|1,0,0]=3 4523 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5760466174 [0,1,0,1,0,0|1,0,0]=3 4524 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5995468864 [0,1,0,1,0,0|1,0,0]=3 4525 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-6230469368 [0,1,0,1,0,0|1,0,0]=3 4526 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-9622062244 [0,1,0,1,0,0|1,0,0]=3 4527 B7R1.2 N[C@H]1COC(=O)C1 MCULE-2936782126 [0,1,0,1,0,0|1,0,1]=4 4528 B7R1.2 N[C@H]1COC(=O)C1 MCULE-4255876921 [0,1,0,1,0,0|1,0,1]=4 4529 B7R1.2 N[C@H]1COC(=O)C1 MCULE-5377151477 [0,1,0,1,0,0|1,0,1]=4 4530 B7R1.2 N[C@H]1COC(=O)C1 MCULE-6406960509 [0,1,0,1,0,0|1,0,1]=4 4531 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [0,1,0,1,0,0|1,0,1]=4 4532 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [0,1,0,1,0,0|0,0,1]=3 4533 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [0,1,0,1,0,0|0,0,1]=3 4534 B7R1.2 O=C1CCC(C1)F MCULE-9585894610 [0,1,0,1,0,0|2,0,0]=4 4535 B7R1.2 O=C1CCC(C1)I MCULE-5558007377 [0,1,0,1,0,0|2,0,0]=4 4536 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [0,1,0,1,0,0|1,0,0]=3 4537 B7R1.2 O=C1CCC(N1)O MCULE-1790956080 [0,1,0,1,0,0|2,0,0]=4 4538 B7R1.2 O=C1CCC(O1)O MCULE-5296344468 [0,1,0,1,0,0|2,0,0]=4 4539 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [0,1,0,1,0,0|1,0,1]=4 4540 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [0,1,0,1,0,0|1,0,1]=4 4541 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [0,1,0,1,0,0|0,0,1]=3 4542 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [0,1,0,1,0,0|0,0,1]=3 4543 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [0,1,0,1,0,0|1,0,1]=4 4544 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [0,1,0,1,0,0|1,0,1]=4 4545 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [0,1,0,1,0,0|0,0,1]=3 4546 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [0,1,0,1,0,0|0,0,1]=3 4547 B7R1.2 O=C1OCC(O1)Cl MCULE-4046020713 [0,1,0,1,0,0|1,0,1]=4 4548 B7R1.2 O=C1OCC(O1)F MCULE-7198712298 [0,1,0,1,0,0|1,0,1]=4 4549 B7R1.2 OC1C=CC(C1)O MCULE-9792113599 [0,1,0,1,0,0|1,0,1]=4 4550 B7R1.2 OC1CCC(C1)O MCULE-2799846813 [0,1,0,1,0,0|1,0,0]=3 4551 B7R1.2 OC1CCC(O1)O MCULE-8012370358 [0,1,0,1,0,0|2,0,0]=4 4552 B7R1.2 O[C@@H]1C=C[C@@H](C1)O MCULE-7187295032 [0,1,0,1,0,0|1,0,1]=4 4553 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-4481324218 [0,1,0,1,0,0|1,0,0]=3 4554 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-6560672131 [0,1,0,1,0,0|1,0,0]=3 4555 B7R1.2 O[C@H]1CC[C@H](C1)O MCULE-4640874873 [0,1,0,1,0,0|1,0,0]=3 4556 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-3137346382 [0,1,0,1,0,0|1,0,0]=3 4557 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-9954737796 [0,1,0,1,0,0|1,0,0]=3 4558 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,1,0,1,0,0|2,0,0]=4 4559 B7R1.2 [C@H]1(CC[C@H](C1)O)O MCULE-4834858159 [0,1,0,1,0,0|1,0,0]=3 4560 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-1916837136 [0,1,0,1,0,0|1,0,0]=3 4561 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-8263093896 [0,1,0,1,0,0|1,0,0]=3 4562 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9065610836 [0,1,0,1,0,0|1,0,0]=3 4563 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9910248291 [0,1,0,1,0,0|1,0,0]=3 4564 B7R1.3 BrC1=CCOCC1 MCULE-7609274912 [0,1,0,1,0,0|1,0,1]=4 4565 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [0,1,0,1,0,0|2,0,0]=4 4566 B7R1.3 BrC1CCCCN1 MCULE-3863852230 [0,1,0,1,0,0|2,0,0]=4 4567 B7R1.3 BrC1CCCCO1 MCULE-3659439382 [0,1,0,1,0,0|1,0,0]=3 4568 B7R1.3 BrC1CCCNC1 MCULE-5734359694 [0,1,0,1,0,0|2,0,0]=4 4569 B7R1.3 BrC1CCCNC1 MCULE-8772964999 [0,1,0,1,0,0|2,0,0]=4 4570 B7R1.3 BrC1CCCNC1 MCULE-9975168983 [0,1,0,1,0,0|2,0,0]=4 4571 B7R1.3 BrC1CCCOC1 MCULE-5781416415 [0,1,0,1,0,0|1,0,0]=3 4572 B7R1.3 BrC1CCNCC1 MCULE-2524082443 [0,1,0,1,0,0|2,0,0]=4 4573 B7R1.3 BrC1CCNCC1 MCULE-9389571955 [0,1,0,1,0,0|2,0,0]=4 4574 B7R1.3 BrC1CCNCC1 MCULE-9646097822 [0,1,0,1,0,0|2,0,0]=4 4575 B7R1.3 BrC1CCOCC1 MCULE-4896539126 [0,1,0,1,0,0|1,0,0]=3 4576 B7R1.3 BrC1CCSCC1 MCULE-1239956252 [0,1,0,1,0,0|1,1,0]=4 4577 B7R1.3 C1(CCCNC1)F MCULE-2873742972 [0,1,0,1,0,0|2,0,0]=4 4578 B7R1.3 C1(CCCNC1)F MCULE-8247715411 [0,1,0,1,0,0|2,0,0]=4 4579 B7R1.3 C1(CCCNC1)N MCULE-2184623611 [0,1,0,1,0,0|2,0,0]=4 4580 B7R1.3 C1(CCCNC1)N MCULE-6177601832 [0,1,0,1,0,0|2,0,0]=4 4581 B7R1.3 C1(CCCNC1)O MCULE-5944071030 [0,1,0,1,0,0|1,0,0]=3 4582 B7R1.3 C1(CCCNC1)O MCULE-9769032939 [0,1,0,1,0,0|1,0,0]=3 4583 B7R1.3 C1(CCCOC1)N MCULE-7160456966 [0,1,0,1,0,0|1,0,0]=3 4584 B7R1.3 C1(CCCOC1)N MCULE-9418657332 [0,1,0,1,0,0|1,0,0]=3 4585 B7R1.3 C1(CNCCN1)C MCULE-7759957935 [0,1,0,1,0,0|2,0,0]=4 4586 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [0,1,0,1,0,0|1,0,0]=3 4587 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [0,1,0,1,0,0|1,0,0]=3 4588 B7R1.3 C=C1CCCCC1 MCULE-9812236661 [0,1,0,1,0,0|2,0,0]=4 4589 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [0,1,0,1,0,0|1,0,1]=4 4590 B7R1.3 C=C1CCNCC1 MCULE-4460895436 [0,1,0,1,0,0|2,0,0]=4 4591 B7R1.3 C=C1CCNCC1 MCULE-6605411269 [0,1,0,1,0,0|2,0,0]=4 4592 B7R1.3 C=C1CCNCC1 MCULE-6729798105 [0,1,0,1,0,0|2,0,0]=4 4593 B7R1.3 C=C1CCOCC1 MCULE-2744722311 [0,1,0,1,0,0|1,0,0]=3 4594 B7R1.3 CB1OCCCO1 MCULE-5692862103 [0,1,0,1,0,0|1,0,0]=3 4595 B7R1.3 CC1=CCCCC1 MCULE-2795172496 [0,1,0,1,0,0|2,0,0]=4 4596 B7R1.3 CC1=CCCNC1 MCULE-8145216779 [0,1,0,1,0,0|2,0,0]=4 4597 B7R1.3 CC1=CCCNC1 MCULE-9021954061 [0,1,0,1,0,0|2,0,0]=4 4598 B7R1.3 CC1=NCCNC1 MCULE-2066788449 [0,1,0,1,0,0|2,0,0]=4 4599 B7R1.3 CC1C=CCCC1 MCULE-8057302830 [0,1,0,1,0,0|2,0,0]=4 4600 B7R1.3 CC1CC=CCC1 MCULE-6343106785 [0,1,0,1,0,0|2,0,0]=4 4601 B7R1.3 CC1CCCCC1 MCULE-3843525768 [0,1,0,1,0,0|2,0,0]=4 4602 B7R1.3 CC1CCCCN1 MCULE-1741870990 [0,1,0,1,0,0|2,0,0]=4 4603 B7R1.3 CC1CCCCN1 MCULE-4453126703 [0,1,0,1,0,0|2,0,0]=4 4604 B7R1.3 CC1CCCCN1 MCULE-6620063962 [0,1,0,1,0,0|2,0,0]=4 4605 B7R1.3 CC1CCCCN1 MCULE-6838766744 [0,1,0,1,0,0|2,0,0]=4 4606 B7R1.3 CC1CCCCN1 MCULE-9227931620 [0,1,0,1,0,0|2,0,0]=4 4607 B7R1.3 CC1CCCCO1 MCULE-4439683294 [0,1,0,1,0,0|1,0,0]=3 4608 B7R1.3 CC1CCCNC1 MCULE-3344207132 [0,1,0,1,0,0|2,0,0]=4 4609 B7R1.3 CC1CCCNC1 MCULE-5707832183 [0,1,0,1,0,0|2,0,0]=4 4610 B7R1.3 CC1CCCNC1 MCULE-7033850891 [0,1,0,1,0,0|2,0,0]=4 4611 B7R1.3 CC1CCCNC1 MCULE-7153943487 [0,1,0,1,0,0|2,0,0]=4 4612 B7R1.3 CC1CCNCC1 MCULE-5873723365 [0,1,0,1,0,0|2,0,0]=4 4613 B7R1.3 CC1CCNCC1 MCULE-6994675149 [0,1,0,1,0,0|2,0,0]=4 4614 B7R1.3 CC1CCNCC1 MCULE-9043030659 [0,1,0,1,0,0|2,0,0]=4 4615 B7R1.3 CC1CCOCC1 MCULE-8623581625 [0,1,0,1,0,0|1,0,0]=3 4616 B7R1.3 CC1CCOCN1 MCULE-5420262342 [0,1,0,1,0,0|1,0,0]=3 4617 B7R1.3 CC1CCOCO1 MCULE-5013590651 [0,1,0,1,0,0|1,0,0]=3 4618 B7R1.3 CC1CNCCN1 MCULE-2536395443 [0,1,0,1,0,0|2,0,0]=4 4619 B7R1.3 CC1CNCCN1 MCULE-6313957247 [0,1,0,1,0,0|2,0,0]=4 4620 B7R1.3 CC1CNCCO1 MCULE-3071497485 [0,1,0,1,0,0|1,0,0]=3 4621 B7R1.3 CC1CNCCO1 MCULE-7956728736 [0,1,0,1,0,0|1,0,0]=3 4622 B7R1.3 CC1CNCCS1 MCULE-7391261862 [0,1,0,1,0,0|1,1,0]=4 4623 B7R1.3 CC1COCCN1 MCULE-1305824409 [0,1,0,1,0,0|1,0,0]=3 4624 B7R1.3 CC1COCCN1 MCULE-4570632464 [0,1,0,1,0,0|1,0,0]=3 4625 B7R1.3 CC1COCCN1 MCULE-6275555682 [0,1,0,1,0,0|1,0,0]=3 4626 B7R1.3 CC1COCCN1 MCULE-8711024794 [0,1,0,1,0,0|1,0,0]=3 4627 B7R1.3 CC1CSCCN1 MCULE-2923436126 [0,1,0,1,0,0|1,1,0]=4 4628 B7R1.3 CC1NCCCO1 MCULE-2236660860 [0,1,0,1,0,0|1,0,0]=3 4629 B7R1.3 CC1SCCCS1 MCULE-8431698431 [0,1,0,1,0,0|0,2,0]=4 4630 B7R1.3 CN1CCCCC1 MCULE-3308944277 [0,1,0,1,0,0|2,0,0]=4 4631 B7R1.3 CN1CCCCO1 MCULE-4407617276 [0,1,0,1,0,0|1,0,0]=3 4632 B7R1.3 CN1CCCCO1 MCULE-6297284655 [0,1,0,1,0,0|1,0,0]=3 4633 B7R1.3 CN1CCNCC1 MCULE-5570228782 [0,1,0,1,0,0|2,0,0]=4 4634 B7R1.3 CN1CCNCC1 MCULE-7182634479 [0,1,0,1,0,0|2,0,0]=4 4635 B7R1.3 CN1CCOCC1 MCULE-1649171852 [0,1,0,1,0,0|1,0,0]=3 4636 B7R1.3 CN1CCSCC1 MCULE-9816739759 [0,1,0,1,0,0|1,1,0]=4 4637 B7R1.3 C[C@@H]1CCCCN1 MCULE-1372285636 [0,1,0,1,0,0|2,0,0]=4 4638 B7R1.3 C[C@@H]1CCCCN1 MCULE-1676908545 [0,1,0,1,0,0|2,0,0]=4 4639 B7R1.3 C[C@@H]1CCCCN1 MCULE-4298634468 [0,1,0,1,0,0|2,0,0]=4 4640 B7R1.3 C[C@@H]1CCCCN1 MCULE-6629826210 [0,1,0,1,0,0|2,0,0]=4 4641 B7R1.3 C[C@@H]1CCCNC1 MCULE-1079173995 [0,1,0,1,0,0|2,0,0]=4 4642 B7R1.3 C[C@@H]1CCCNC1 MCULE-1230145662 [0,1,0,1,0,0|2,0,0]=4 4643 B7R1.3 C[C@@H]1CCCNC1 MCULE-3423787676 [0,1,0,1,0,0|2,0,0]=4 4644 B7R1.3 C[C@@H]1CCCNC1 MCULE-9303264483 [0,1,0,1,0,0|2,0,0]=4 4645 B7R1.3 C[C@@H]1CNCCN1 MCULE-2959336973 [0,1,0,1,0,0|2,0,0]=4 4646 B7R1.3 C[C@@H]1CNCCN1 MCULE-3870060141 [0,1,0,1,0,0|2,0,0]=4 4647 B7R1.3 C[C@@H]1CNCCN1 MCULE-4214817913 [0,1,0,1,0,0|2,0,0]=4 4648 B7R1.3 C[C@@H]1CNCCN1 MCULE-4368092239 [0,1,0,1,0,0|2,0,0]=4 4649 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [0,1,0,1,0,0|1,0,0]=3 4650 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [0,1,0,1,0,0|1,0,0]=3 4651 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [0,1,0,1,0,0|1,0,0]=3 4652 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [0,1,0,1,0,0|1,0,0]=3 4653 B7R1.3 C[C@@H]1COCCN1 MCULE-2750151013 [0,1,0,1,0,0|1,0,0]=3 4654 B7R1.3 C[C@@H]1COCCN1 MCULE-4003273424 [0,1,0,1,0,0|1,0,0]=3 4655 B7R1.3 C[C@@H]1COCCN1 MCULE-4627627990 [0,1,0,1,0,0|1,0,0]=3 4656 B7R1.3 C[C@@H]1COCCN1 MCULE-8600287111 [0,1,0,1,0,0|1,0,0]=3 4657 B7R1.3 C[C@@H]1CSCCN1 MCULE-2613889704 [0,1,0,1,0,0|1,1,0]=4 4658 B7R1.3 C[C@H]1CCCCN1 MCULE-3586455704 [0,1,0,1,0,0|2,0,0]=4 4659 B7R1.3 C[C@H]1CCCCN1 MCULE-5638638213 [0,1,0,1,0,0|2,0,0]=4 4660 B7R1.3 C[C@H]1CCCCN1 MCULE-5867717461 [0,1,0,1,0,0|2,0,0]=4 4661 B7R1.3 C[C@H]1CCCCN1 MCULE-7106826493 [0,1,0,1,0,0|2,0,0]=4 4662 B7R1.3 C[C@H]1CCCNC1 MCULE-3372852932 [0,1,0,1,0,0|2,0,0]=4 4663 B7R1.3 C[C@H]1CCCNC1 MCULE-5146147676 [0,1,0,1,0,0|2,0,0]=4 4664 B7R1.3 C[C@H]1CCCNC1 MCULE-7894943546 [0,1,0,1,0,0|2,0,0]=4 4665 B7R1.3 C[C@H]1CCCNC1 MCULE-8016414984 [0,1,0,1,0,0|2,0,0]=4 4666 B7R1.3 C[C@H]1CNCCN1 MCULE-1403559972 [0,1,0,1,0,0|2,0,0]=4 4667 B7R1.3 C[C@H]1CNCCN1 MCULE-5769724060 [0,1,0,1,0,0|2,0,0]=4 4668 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [0,1,0,1,0,0|1,0,0]=3 4669 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [0,1,0,1,0,0|1,0,0]=3 4670 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [0,1,0,1,0,0|1,0,0]=3 4671 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [0,1,0,1,0,0|1,0,0]=3 4672 B7R1.3 C[C@H]1COCCN1 MCULE-1467834624 [0,1,0,1,0,0|1,0,0]=3 4673 B7R1.3 C[C@H]1COCCN1 MCULE-3486079226 [0,1,0,1,0,0|1,0,0]=3 4674 B7R1.3 C[C@H]1COCCN1 MCULE-5726525044 [0,1,0,1,0,0|1,0,0]=3 4675 B7R1.3 C[C@H]1COCCN1 MCULE-9977133603 [0,1,0,1,0,0|1,0,0]=3 4676 B7R1.3 C[C@H]1CSCCN1 MCULE-4076273874 [0,1,0,1,0,0|1,1,0]=4 4677 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [0,1,0,1,0,0|2,0,0]=4 4678 B7R1.3 ClC1CCCCO1 MCULE-3251653488 [0,1,0,1,0,0|1,0,0]=3 4679 B7R1.3 ClC1CCCNC1 MCULE-3870722463 [0,1,0,1,0,0|2,0,0]=4 4680 B7R1.3 ClC1CCCNC1 MCULE-8461718443 [0,1,0,1,0,0|2,0,0]=4 4681 B7R1.3 ClC1CCCOC1 MCULE-5733907796 [0,1,0,1,0,0|1,0,0]=3 4682 B7R1.3 ClC1CCNCC1 MCULE-1320213535 [0,1,0,1,0,0|2,0,0]=4 4683 B7R1.3 ClC1CCNCC1 MCULE-3278149456 [0,1,0,1,0,0|2,0,0]=4 4684 B7R1.3 ClC1CCOCC1 MCULE-5672440693 [0,1,0,1,0,0|1,0,0]=3 4685 B7R1.3 ClN1CCOCC1 MCULE-2275187473 [0,1,0,1,0,0|1,0,0]=3 4686 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-1513190720 [0,1,0,1,0,0|2,0,0]=4 4687 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-4702442384 [0,1,0,1,0,0|2,0,0]=4 4688 B7R1.3 Cl[C@H]1CCCNC1 MCULE-1906196638 [0,1,0,1,0,0|2,0,0]=4 4689 B7R1.3 Cl[C@H]1CCCNC1 MCULE-5435721723 [0,1,0,1,0,0|2,0,0]=4 4690 B7R1.3 FC1CCCCC1 MCULE-4555555520 [0,1,0,1,0,0|2,0,0]=4 4691 B7R1.3 FC1CCCCO1 MCULE-8724227177 [0,1,0,1,0,0|1,0,0]=3 4692 B7R1.3 FC1CCCNC1 MCULE-1207637035 [0,1,0,1,0,0|2,0,0]=4 4693 B7R1.3 FC1CCCNC1 MCULE-8874983109 [0,1,0,1,0,0|2,0,0]=4 4694 B7R1.3 FC1CCCOC1 MCULE-9003204358 [0,1,0,1,0,0|1,0,0]=3 4695 B7R1.3 FC1CCNCC1 MCULE-1146732226 [0,1,0,1,0,0|2,0,0]=4 4696 B7R1.3 FC1CCNCC1 MCULE-9481825539 [0,1,0,1,0,0|2,0,0]=4 4697 B7R1.3 F[C@@H]1CCCNC1 MCULE-1015853975 [0,1,0,1,0,0|2,0,0]=4 4698 B7R1.3 F[C@@H]1CCCNC1 MCULE-2442101978 [0,1,0,1,0,0|2,0,0]=4 4699 B7R1.3 F[C@@H]1CCCNC1 MCULE-3088687742 [0,1,0,1,0,0|2,0,0]=4 4700 B7R1.3 F[C@@H]1CCCNC1 MCULE-3298158493 [0,1,0,1,0,0|2,0,0]=4 4701 B7R1.3 F[C@H]1CCCNC1 MCULE-5863769143 [0,1,0,1,0,0|2,0,0]=4 4702 B7R1.3 F[C@H]1CCCNC1 MCULE-9142728260 [0,1,0,1,0,0|2,0,0]=4 4703 B7R1.3 F[C@H]1CCCNC1 MCULE-9496728832 [0,1,0,1,0,0|2,0,0]=4 4704 B7R1.3 F[C@H]1CCCNC1 MCULE-9795686850 [0,1,0,1,0,0|2,0,0]=4 4705 B7R1.3 IC1CCCCC1 MCULE-4499971048 [0,1,0,1,0,0|2,0,0]=4 4706 B7R1.3 IC1CCNCC1 MCULE-1161879837 [0,1,0,1,0,0|2,0,0]=4 4707 B7R1.3 IC1CCNCC1 MCULE-3953687682 [0,1,0,1,0,0|2,0,0]=4 4708 B7R1.3 IC1CCOCC1 MCULE-7226892860 [0,1,0,1,0,0|1,0,0]=3 4709 B7R1.3 IC1CCSCC1 MCULE-6684613275 [0,1,0,1,0,0|1,1,0]=4 4710 B7R1.3 IN1CCOCC1 MCULE-2342142292 [0,1,0,1,0,0|1,0,0]=3 4711 B7R1.3 IN1CCOCC1 MCULE-6623188938 [0,1,0,1,0,0|1,0,0]=3 4712 B7R1.3 NC1CC=CCC1 MCULE-4040563231 [0,1,0,1,0,0|2,0,0]=4 4713 B7R1.3 NC1CC=CCC1 MCULE-9904098902 [0,1,0,1,0,0|2,0,0]=4 4714 B7R1.3 NC1CCCCC1 MCULE-1274688385 [0,1,0,1,0,0|2,0,0]=4 4715 B7R1.3 NC1CCCCC1 MCULE-6218418825 [0,1,0,1,0,0|2,0,0]=4 4716 B7R1.3 NC1CCCCC1 MCULE-7654331405 [0,1,0,1,0,0|2,0,0]=4 4717 B7R1.3 NC1CCCCC1 MCULE-9211684304 [0,1,0,1,0,0|2,0,0]=4 4718 B7R1.3 NC1CCCCN1 MCULE-8429969520 [0,1,0,1,0,0|2,0,0]=4 4719 B7R1.3 NC1CCCNC1 MCULE-2846077424 [0,1,0,1,0,0|2,0,0]=4 4720 B7R1.3 NC1CCCNC1 MCULE-6762552983 [0,1,0,1,0,0|2,0,0]=4 4721 B7R1.3 NC1CCCNC1 MCULE-8978449052 [0,1,0,1,0,0|2,0,0]=4 4722 B7R1.3 NC1CCCOC1 MCULE-3002610862 [0,1,0,1,0,0|1,0,0]=3 4723 B7R1.3 NC1CCCOC1 MCULE-8678558313 [0,1,0,1,0,0|1,0,0]=3 4724 B7R1.3 NC1CCCSC1 MCULE-5361360271 [0,1,0,1,0,0|1,1,0]=4 4725 B7R1.3 NC1CCCSC1 MCULE-5652416535 [0,1,0,1,0,0|1,1,0]=4 4726 B7R1.3 NC1CCNCC1 MCULE-4122223472 [0,1,0,1,0,0|2,0,0]=4 4727 B7R1.3 NC1CCNCC1 MCULE-4894618503 [0,1,0,1,0,0|2,0,0]=4 4728 B7R1.3 NC1CCOCC1 MCULE-4830730893 [0,1,0,1,0,0|1,0,0]=3 4729 B7R1.3 NC1CCOCC1 MCULE-6229850202 [0,1,0,1,0,0|1,0,0]=3 4730 B7R1.3 NC1CCOCC1 MCULE-7619874469 [0,1,0,1,0,0|1,0,0]=3 4731 B7R1.3 NC1CCSCC1 MCULE-1077822824 [0,1,0,1,0,0|1,1,0]=4 4732 B7R1.3 NC1CCSCC1 MCULE-7148332202 [0,1,0,1,0,0|1,1,0]=4 4733 B7R1.3 NN1CCCCC1 MCULE-2078041523 [0,1,0,1,0,0|2,0,0]=4 4734 B7R1.3 NN1CCCCC1 MCULE-3853977450 [0,1,0,1,0,0|2,0,0]=4 4735 B7R1.3 NN1CCNCC1 MCULE-4047900576 [0,1,0,1,0,0|2,0,0]=4 4736 B7R1.3 NN1CCNCC1 MCULE-5083416150 [0,1,0,1,0,0|2,0,0]=4 4737 B7R1.3 NN1CCNCC1 MCULE-7309844454 [0,1,0,1,0,0|2,0,0]=4 4738 B7R1.3 NN1CCOCC1 MCULE-8277539965 [0,1,0,1,0,0|1,0,0]=3 4739 B7R1.3 NN1CCSCC1 MCULE-9712464832 [0,1,0,1,0,0|1,1,0]=4 4740 B7R1.3 N[C@@H]1CC=CCC1 MCULE-7764023195 [0,1,0,1,0,0|2,0,0]=4 4741 B7R1.3 N[C@@H]1CC=CCC1 MCULE-7983408030 [0,1,0,1,0,0|2,0,0]=4 4742 B7R1.3 N[C@@H]1CCCNC1 MCULE-1539406556 [0,1,0,1,0,0|2,0,0]=4 4743 B7R1.3 N[C@@H]1CCCNC1 MCULE-3403472114 [0,1,0,1,0,0|2,0,0]=4 4744 B7R1.3 N[C@@H]1CCCNC1 MCULE-6313396868 [0,1,0,1,0,0|2,0,0]=4 4745 B7R1.3 N[C@@H]1CCCNC1 MCULE-8281902784 [0,1,0,1,0,0|2,0,0]=4 4746 B7R1.3 N[C@@H]1CCCOC1 MCULE-3329999118 [0,1,0,1,0,0|1,0,0]=3 4747 B7R1.3 N[C@@H]1CCCOC1 MCULE-5434456311 [0,1,0,1,0,0|1,0,0]=3 4748 B7R1.3 N[C@@H]1CCCOC1 MCULE-8416525332 [0,1,0,1,0,0|1,0,0]=3 4749 B7R1.3 N[C@@H]1CCCOC1 MCULE-9941756618 [0,1,0,1,0,0|1,0,0]=3 4750 B7R1.3 N[C@H]1CC=CCC1 MCULE-2054948922 [0,1,0,1,0,0|2,0,0]=4 4751 B7R1.3 N[C@H]1CC=CCC1 MCULE-6634059436 [0,1,0,1,0,0|2,0,0]=4 4752 B7R1.3 N[C@H]1CCCNC1 MCULE-1133561466 [0,1,0,1,0,0|2,0,0]=4 4753 B7R1.3 N[C@H]1CCCNC1 MCULE-3601314617 [0,1,0,1,0,0|2,0,0]=4 4754 B7R1.3 N[C@H]1CCCNC1 MCULE-4741120465 [0,1,0,1,0,0|2,0,0]=4 4755 B7R1.3 N[C@H]1CCCNC1 MCULE-5291619589 [0,1,0,1,0,0|2,0,0]=4 4756 B7R1.3 N[C@H]1CCCNC1 MCULE-8831721515 [0,1,0,1,0,0|2,0,0]=4 4757 B7R1.3 N[C@H]1CCCOC1 MCULE-1619050625 [0,1,0,1,0,0|1,0,0]=3 4758 B7R1.3 N[C@H]1CCCOC1 MCULE-4275969826 [0,1,0,1,0,0|1,0,0]=3 4759 B7R1.3 N[C@H]1CCCOC1 MCULE-4421099383 [0,1,0,1,0,0|1,0,0]=3 4760 B7R1.3 N[C@H]1CCCOC1 MCULE-9281030983 [0,1,0,1,0,0|1,0,0]=3 4761 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,1,0,1,0,0|1,0,1]=4 4762 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,1,0,1,0,0|1,0,1]=4 4763 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,1,0,1,0,0|0,0,2]=4 4764 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,1,0,1,0,0|1,0,1]=4 4765 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,1,0,1,0,0|1,0,1]=4 4766 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,1,0,1,0,0|0,0,1]=3 4767 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,1,0,1,0,0|0,1,1]=4 4768 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,1,0,1,0,0|1,0,1]=4 4769 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,1,0,1,0,0|1,0,1]=4 4770 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,1,0,1,0,0|0,0,2]=4 4771 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,1,0,1,0,0|0,0,1]=3 4772 B7R1.3 O=C1OCCCO1 MCULE-7728322911 [0,1,0,1,0,0|1,0,1]=4 4773 B7R1.3 O=P1OCCCO1 MCULE-9154920312 [0,1,0,1,0,0|2,0,0]=4 4774 B7R1.3 O=S1CCCCC1 MCULE-1275253796 [0,1,0,1,0,0|1,0,1]=4 4775 B7R1.3 O=S1CCNCC1 MCULE-1812570930 [0,1,0,1,0,0|1,0,1]=4 4776 B7R1.3 O=S1CCNCC1 MCULE-9878649050 [0,1,0,1,0,0|1,0,1]=4 4777 B7R1.3 O=S1CCOCC1 MCULE-4979531002 [0,1,0,1,0,0|0,0,1]=3 4778 B7R1.3 O=S1OCCCO1 MCULE-4755606100 [0,1,0,1,0,0|2,0,0]=4 4779 B7R1.3 OB1OCCCO1 MCULE-7976289917 [0,1,0,1,0,0|2,0,0]=4 4780 B7R1.3 OC1C=CCCC1 MCULE-3255466542 [0,1,0,1,0,0|1,0,1]=4 4781 B7R1.3 OC1C=CCNC1 MCULE-1616136732 [0,1,0,1,0,0|1,0,1]=4 4782 B7R1.3 OC1C=CCNC1 MCULE-6073391464 [0,1,0,1,0,0|1,0,1]=4 4783 B7R1.3 OC1C=CCOC1 MCULE-7810293257 [0,1,0,1,0,0|0,0,1]=3 4784 B7R1.3 OC1CC=CCC1 MCULE-9472259407 [0,1,0,1,0,0|1,0,0]=3 4785 B7R1.3 OC1CCCCC1 MCULE-8217921343 [0,1,0,1,0,0|1,0,0]=3 4786 B7R1.3 OC1CCCCN1 MCULE-7168605870 [0,1,0,1,0,0|1,0,0]=3 4787 B7R1.3 OC1CCCCN1 MCULE-9833825308 [0,1,0,1,0,0|1,0,0]=3 4788 B7R1.3 OC1CCCCO1 MCULE-1415784498 [0,1,0,1,0,0|1,0,0]=3 4789 B7R1.3 OC1CCCNC1 MCULE-4557845355 [0,1,0,1,0,0|1,0,0]=3 4790 B7R1.3 OC1CCCNC1 MCULE-6040312691 [0,1,0,1,0,0|1,0,0]=3 4791 B7R1.3 OC1CCCOC1 MCULE-3820663957 [0,1,0,1,0,0|0,0,0]=2 4792 B7R1.3 OC1CCCOC1 MCULE-4349250540 [0,1,0,1,0,0|0,0,0]=2 4793 B7R1.3 OC1CCCSC1 MCULE-1448781710 [0,1,0,1,0,0|0,1,0]=3 4794 B7R1.3 OC1CCNCC1 MCULE-3572807775 [0,1,0,1,0,0|1,0,0]=3 4795 B7R1.3 OC1CCNCC1 MCULE-4216905638 [0,1,0,1,0,0|1,0,0]=3 4796 B7R1.3 OC1CCNCC1 MCULE-8298401309 [0,1,0,1,0,0|1,0,0]=3 4797 B7R1.3 OC1CCOCC1 MCULE-3789534226 [0,1,0,1,0,0|0,0,0]=2 4798 B7R1.3 OC1CCSCC1 MCULE-6056663037 [0,1,0,1,0,0|0,1,0]=3 4799 B7R1.3 OC1CNCCO1 MCULE-7048275202 [0,1,0,1,0,0|1,0,0]=3 4800 B7R1.3 OC1CNCCO1 MCULE-9716087824 [0,1,0,1,0,0|1,0,0]=3 4801 B7R1.3 OC1COCOC1 MCULE-1056094446 [0,1,0,1,0,0|0,0,0]=2 4802 B7R1.3 ON1CCCCC1 MCULE-5529301217 [0,1,0,1,0,0|1,0,0]=3 4803 B7R1.3 ON1CCOCC1 MCULE-9071295312 [0,1,0,1,0,0|0,0,0]=2 4804 B7R1.3 O[C@@H]1CCCNC1 MCULE-3395625072 [0,1,0,1,0,0|1,0,0]=3 4805 B7R1.3 O[C@@H]1CCCNC1 MCULE-5041834047 [0,1,0,1,0,0|1,0,0]=3 4806 B7R1.3 O[C@@H]1CCCNC1 MCULE-5939951996 [0,1,0,1,0,0|1,0,0]=3 4807 B7R1.3 O[C@@H]1CCCNC1 MCULE-8822637089 [0,1,0,1,0,0|1,0,0]=3 4808 B7R1.3 O[C@@H]1CCCOC1 MCULE-1439860824 [0,1,0,1,0,0|0,0,0]=2 4809 B7R1.3 O[C@@H]1CCCOC1 MCULE-5515107963 [0,1,0,1,0,0|0,0,0]=2 4810 B7R1.3 O[C@H]1C=CCCC1 MCULE-5543899109 [0,1,0,1,0,0|1,0,1]=4 4811 B7R1.3 O[C@H]1CCCNC1 MCULE-3813591488 [0,1,0,1,0,0|1,0,0]=3 4812 B7R1.3 O[C@H]1CCCNC1 MCULE-5223055424 [0,1,0,1,0,0|1,0,0]=3 4813 B7R1.3 O[C@H]1CCCNC1 MCULE-7646198322 [0,1,0,1,0,0|1,0,0]=3 4814 B7R1.3 O[C@H]1CCCNC1 MCULE-7875547684 [0,1,0,1,0,0|1,0,0]=3 4815 B7R1.3 O[C@H]1CCCOC1 MCULE-2228949296 [0,1,0,1,0,0|0,0,0]=2 4816 B7R1.3 O[C@H]1CCCOC1 MCULE-6500179909 [0,1,0,1,0,0|0,0,0]=2 4817 B7R1.3 S=C1CCCCC1 MCULE-6072375043 [0,1,0,1,0,0|1,1,0]=4 4818 B7R1.3 S=C1COCCN1 MCULE-1743172522 [0,1,0,1,0,0|0,1,1]=4 4819 B7R1.3 SC1CCCCC1 MCULE-2644288416 [0,1,0,1,0,0|1,1,0]=4 4820 B7R1.3 SC1CCCNC1 MCULE-4464031027 [0,1,0,1,0,0|1,1,0]=4 4821 B7R1.3 SC1CCCNC1 MCULE-5566651293 [0,1,0,1,0,0|1,1,0]=4 4822 B7R1.3 SC1CCCOC1 MCULE-9540212924 [0,1,0,1,0,0|0,1,0]=3 4823 B7R1.3 SC1CCNCC1 MCULE-2780144586 [0,1,0,1,0,0|1,1,0]=4 4824 B7R1.3 SC1CCNCC1 MCULE-4297654743 [0,1,0,1,0,0|1,1,0]=4 4825 B7R1.3 SC1CCOCC1 MCULE-1287019115 [0,1,0,1,0,0|0,1,0]=3 4826 B7R1.3 SC1CCSCC1 MCULE-8741596394 [0,1,0,1,0,0|0,2,0]=4 4827 B7R1.3 S[C@H]1CCCNC1 MCULE-5377455102 [0,1,0,1,0,0|1,1,0]=4 4828 B7R1.3 S[C@H]1CCCNC1 MCULE-9668422285 [0,1,0,1,0,0|1,1,0]=4 4829 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [0,1,0,1,0,0|2,0,0]=4 4830 B7R1.4 BrC1CCCC1Br MCULE-9172342979 [0,1,0,1,0,0|2,0,0]=4 4831 B7R1.4 Br[C@@H]1CCC[C@H]1Br MCULE-5523481790 [0,1,0,1,0,0|2,0,0]=4 4832 B7R1.4 C=C1CCCC1O MCULE-3026250203 [0,1,0,1,0,0|1,0,1]=4 4833 B7R1.4 C=C1COCC1N MCULE-4632261286 [0,1,0,1,0,0|1,0,1]=4 4834 B7R1.4 C=C1COCC1N MCULE-7153575301 [0,1,0,1,0,0|1,0,1]=4 4835 B7R1.4 CC1CCCC1=O MCULE-3710290162 [0,1,0,1,0,0|1,0,1]=4 4836 B7R1.4 CC1CCCC1Br MCULE-7816907673 [0,1,0,1,0,0|2,0,0]=4 4837 B7R1.4 CC1CCCC1N MCULE-4318156403 [0,1,0,1,0,0|2,0,0]=4 4838 B7R1.4 CC1CCCC1N MCULE-4434172193 [0,1,0,1,0,0|2,0,0]=4 4839 B7R1.4 CC1CCCC1O MCULE-1288711765 [0,1,0,1,0,0|1,0,0]=3 4840 B7R1.4 CC1CCNC1C MCULE-2184586167 [0,1,0,1,0,0|2,0,0]=4 4841 B7R1.4 CC1CCOC1=O MCULE-2223078294 [0,1,0,1,0,0|1,0,1]=4 4842 B7R1.4 CC1CNCC1C MCULE-5821391512 [0,1,0,1,0,0|2,0,0]=4 4843 B7R1.4 CC1CNCC1C MCULE-6626101399 [0,1,0,1,0,0|2,0,0]=4 4844 B7R1.4 CC1CNCC1F MCULE-4834888455 [0,1,0,1,0,0|2,0,0]=4 4845 B7R1.4 CC1CNCC1F MCULE-7766072724 [0,1,0,1,0,0|2,0,0]=4 4846 B7R1.4 CC1CNCC1N MCULE-2314973615 [0,1,0,1,0,0|2,0,0]=4 4847 B7R1.4 CC1CNCC1N MCULE-8542352354 [0,1,0,1,0,0|2,0,0]=4 4848 B7R1.4 CC1CNCC1O MCULE-3308447861 [0,1,0,1,0,0|1,0,0]=3 4849 B7R1.4 CC1CNCC1O MCULE-8526879323 [0,1,0,1,0,0|1,0,0]=3 4850 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,1,0,1,0,0|0,0,2]=4 4851 B7R1.4 CC1COCC1N MCULE-5453471722 [0,1,0,1,0,0|1,0,0]=3 4852 B7R1.4 CC1COCC1N MCULE-6647217023 [0,1,0,1,0,0|1,0,0]=3 4853 B7R1.4 CC1COCC1O MCULE-5925280081 [0,1,0,1,0,0|0,0,0]=2 4854 B7R1.4 CC1CSCC1N MCULE-5628200403 [0,1,0,1,0,0|1,1,0]=4 4855 B7R1.4 CC1NCCC1=O MCULE-4206844406 [0,1,0,1,0,0|1,0,1]=4 4856 B7R1.4 CC1NCCC1=O MCULE-7025918222 [0,1,0,1,0,0|1,0,1]=4 4857 B7R1.4 CC1NCCC1O MCULE-7936666458 [0,1,0,1,0,0|1,0,0]=3 4858 B7R1.4 CC1NCCC1O MCULE-8369948926 [0,1,0,1,0,0|1,0,0]=3 4859 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,1,0,1,0,0|0,0,1]=3 4860 B7R1.4 CC1OCCC1N MCULE-4343663724 [0,1,0,1,0,0|1,0,0]=3 4861 B7R1.4 CC1OCCC1N MCULE-9003879039 [0,1,0,1,0,0|1,0,0]=3 4862 B7R1.4 CC1OCCC1O MCULE-6904695721 [0,1,0,1,0,0|0,0,0]=2 4863 B7R1.4 CC1OCCC1S MCULE-9127694888 [0,1,0,1,0,0|0,1,0]=3 4864 B7R1.4 CC1OCOC1C MCULE-9497186094 [0,1,0,1,0,0|1,0,0]=3 4865 B7R1.4 CC1SCCC1=O MCULE-5264322365 [0,1,0,1,0,0|0,1,1]=4 4866 B7R1.4 CC1SCCC1N MCULE-5160182865 [0,1,0,1,0,0|1,1,0]=4 4867 B7R1.4 CC1SCCC1N MCULE-8827106279 [0,1,0,1,0,0|1,1,0]=4 4868 B7R1.4 CC1SCCC1O MCULE-4342593310 [0,1,0,1,0,0|0,1,0]=3 4869 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [0,1,0,1,0,0|2,0,0]=4 4870 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [0,1,0,1,0,0|2,0,0]=4 4871 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [0,1,0,1,0,0|1,0,0]=3 4872 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [0,1,0,1,0,0|2,0,0]=4 4873 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [0,1,0,1,0,0|1,0,0]=3 4874 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-4592161485 [0,1,0,1,0,0|2,0,0]=4 4875 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-5506149631 [0,1,0,1,0,0|2,0,0]=4 4876 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-4204399527 [0,1,0,1,0,0|2,0,0]=4 4877 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-8451199903 [0,1,0,1,0,0|2,0,0]=4 4878 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2290594563 [0,1,0,1,0,0|2,0,0]=4 4879 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2611807697 [0,1,0,1,0,0|2,0,0]=4 4880 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-3707409979 [0,1,0,1,0,0|2,0,0]=4 4881 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-4317636252 [0,1,0,1,0,0|2,0,0]=4 4882 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [0,1,0,1,0,0|1,0,0]=3 4883 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [0,1,0,1,0,0|1,0,0]=3 4884 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [0,1,0,1,0,0|1,0,0]=3 4885 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [0,1,0,1,0,0|1,0,0]=3 4886 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [0,1,0,1,0,0|1,0,0]=3 4887 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [0,1,0,1,0,0|1,0,0]=3 4888 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-2567871968 [0,1,0,1,0,0|2,0,0]=4 4889 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-5626188867 [0,1,0,1,0,0|2,0,0]=4 4890 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-7438009663 [0,1,0,1,0,0|2,0,0]=4 4891 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-8649896095 [0,1,0,1,0,0|2,0,0]=4 4892 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [0,1,0,1,0,0|1,0,0]=3 4893 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [0,1,0,1,0,0|1,0,0]=3 4894 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [0,1,0,1,0,0|1,0,0]=3 4895 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [0,1,0,1,0,0|1,0,0]=3 4896 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [0,1,0,1,0,0|0,0,0]=2 4897 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-1145772262 [0,1,0,1,0,0|1,0,0]=3 4898 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-6639849267 [0,1,0,1,0,0|1,0,0]=3 4899 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-9659959713 [0,1,0,1,0,0|1,0,0]=3 4900 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [0,1,0,1,0,0|0,0,0]=2 4901 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-1705265213 [0,1,0,1,0,0|1,0,0]=3 4902 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-3395898129 [0,1,0,1,0,0|1,0,0]=3 4903 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-5909894286 [0,1,0,1,0,0|1,0,0]=3 4904 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-9998480727 [0,1,0,1,0,0|1,0,0]=3 4905 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-1101330824 [0,1,0,1,0,0|1,0,0]=3 4906 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3326131093 [0,1,0,1,0,0|1,0,0]=3 4907 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3941456644 [0,1,0,1,0,0|1,0,0]=3 4908 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-8944150043 [0,1,0,1,0,0|1,0,0]=3 4909 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [0,1,0,1,0,0|1,0,0]=3 4910 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [0,1,0,1,0,0|1,0,0]=3 4911 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [0,1,0,1,0,0|2,0,0]=4 4912 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [0,1,0,1,0,0|1,0,0]=3 4913 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [0,1,0,1,0,0|1,0,0]=3 4914 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [0,1,0,1,0,0|2,0,0]=4 4915 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [0,1,0,1,0,0|2,0,0]=4 4916 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [0,1,0,1,0,0|1,0,0]=3 4917 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [0,1,0,1,0,0|1,0,0]=3 4918 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7622265949 [0,1,0,1,0,0|2,0,0]=4 4919 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7686056776 [0,1,0,1,0,0|2,0,0]=4 4920 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2214344957 [0,1,0,1,0,0|2,0,0]=4 4921 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2877312650 [0,1,0,1,0,0|2,0,0]=4 4922 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [0,1,0,1,0,0|1,0,0]=3 4923 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [0,1,0,1,0,0|1,0,0]=3 4924 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [0,1,0,1,0,0|1,0,0]=3 4925 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [0,1,0,1,0,0|1,0,0]=3 4926 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-6069899229 [0,1,0,1,0,0|2,0,0]=4 4927 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-8539137579 [0,1,0,1,0,0|2,0,0]=4 4928 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [0,1,0,1,0,0|1,0,0]=3 4929 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [0,1,0,1,0,0|1,0,0]=3 4930 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [0,1,0,1,0,0|1,0,0]=3 4931 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [0,1,0,1,0,0|1,0,0]=3 4932 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [0,1,0,1,0,0|0,0,0]=2 4933 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [0,1,0,1,0,0|0,0,0]=2 4934 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [0,1,0,1,0,0|0,0,0]=2 4935 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [0,1,0,1,0,0|0,0,0]=2 4936 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-5499798144 [0,1,0,1,0,0|1,0,0]=3 4937 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-7401004387 [0,1,0,1,0,0|1,0,0]=3 4938 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-7469942077 [0,1,0,1,0,0|1,0,0]=3 4939 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-9976903585 [0,1,0,1,0,0|1,0,0]=3 4940 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [0,1,0,1,0,0|1,0,0]=3 4941 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [0,1,0,1,0,0|1,0,0]=3 4942 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [0,1,0,1,0,0|1,0,0]=3 4943 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [0,1,0,1,0,0|1,0,0]=3 4944 B7R1.4 ClC1CCCC1Cl MCULE-1176916477 [0,1,0,1,0,0|2,0,0]=4 4945 B7R1.4 ClC1CCOC1Cl MCULE-1186010832 [0,1,0,1,0,0|1,0,0]=3 4946 B7R1.4 FC1CNCC1F MCULE-2795759224 [0,1,0,1,0,0|2,0,0]=4 4947 B7R1.4 FC1CNCC1F MCULE-4642260114 [0,1,0,1,0,0|2,0,0]=4 4948 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-1572445063 [0,1,0,1,0,0|2,0,0]=4 4949 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4177562777 [0,1,0,1,0,0|2,0,0]=4 4950 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4519639793 [0,1,0,1,0,0|2,0,0]=4 4951 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-5389552975 [0,1,0,1,0,0|2,0,0]=4 4952 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-6385794790 [0,1,0,1,0,0|2,0,0]=4 4953 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-7723721112 [0,1,0,1,0,0|2,0,0]=4 4954 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1910510712 [0,1,0,1,0,0|2,0,0]=4 4955 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1939514822 [0,1,0,1,0,0|2,0,0]=4 4956 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-7688312295 [0,1,0,1,0,0|2,0,0]=4 4957 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-9195313321 [0,1,0,1,0,0|2,0,0]=4 4958 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1191772323 [0,1,0,1,0,0|2,0,0]=4 4959 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1441165331 [0,1,0,1,0,0|2,0,0]=4 4960 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-2941635831 [0,1,0,1,0,0|2,0,0]=4 4961 B7R1.4 NC1CCCC1F MCULE-2221939717 [0,1,0,1,0,0|2,0,0]=4 4962 B7R1.4 NC1CCCC1F MCULE-7473190715 [0,1,0,1,0,0|2,0,0]=4 4963 B7R1.4 NC1CCCC1N MCULE-5161769230 [0,1,0,1,0,0|2,0,0]=4 4964 B7R1.4 NC1CCCC1N MCULE-7834445190 [0,1,0,1,0,0|2,0,0]=4 4965 B7R1.4 NC1CCCC1O MCULE-1657591641 [0,1,0,1,0,0|1,0,0]=3 4966 B7R1.4 NC1CCCC1O MCULE-6248992494 [0,1,0,1,0,0|1,0,0]=3 4967 B7R1.4 NC1CCOC1=O MCULE-1011670330 [0,1,0,1,0,0|1,0,1]=4 4968 B7R1.4 NC1CCOC1=O MCULE-1366805966 [0,1,0,1,0,0|1,0,1]=4 4969 B7R1.4 NC1CCOC1=O MCULE-1874490478 [0,1,0,1,0,0|1,0,1]=4 4970 B7R1.4 NC1CCOC1=O MCULE-4434379753 [0,1,0,1,0,0|1,0,1]=4 4971 B7R1.4 NC1CCOC1=O MCULE-7302633352 [0,1,0,1,0,0|1,0,1]=4 4972 B7R1.4 NC1CCOC1=O MCULE-8009953591 [0,1,0,1,0,0|1,0,1]=4 4973 B7R1.4 NC1CNCC1F MCULE-1177091135 [0,1,0,1,0,0|2,0,0]=4 4974 B7R1.4 NC1CNCC1F MCULE-8259596061 [0,1,0,1,0,0|2,0,0]=4 4975 B7R1.4 NC1COCC1Br MCULE-5821692966 [0,1,0,1,0,0|1,0,0]=3 4976 B7R1.4 NC1COCC1F MCULE-5032224318 [0,1,0,1,0,0|1,0,0]=3 4977 B7R1.4 NC1COCC1F MCULE-8302920845 [0,1,0,1,0,0|1,0,0]=3 4978 B7R1.4 NC1COCC1N MCULE-1202195361 [0,1,0,1,0,0|1,0,0]=3 4979 B7R1.4 NC1COCC1N MCULE-4117465167 [0,1,0,1,0,0|1,0,0]=3 4980 B7R1.4 NC1COCC1O MCULE-3115911209 [0,1,0,1,0,0|0,0,0]=2 4981 B7R1.4 NC1COCC1O MCULE-9837103399 [0,1,0,1,0,0|0,0,0]=2 4982 B7R1.4 NC1CSCC1O MCULE-4474934833 [0,1,0,1,0,0|0,1,0]=3 4983 B7R1.4 NC1CSCC1O MCULE-5059305463 [0,1,0,1,0,0|0,1,0]=3 4984 B7R1.4 NC1CSCC1O MCULE-8633680588 [0,1,0,1,0,0|0,1,0]=3 4985 B7R1.4 N[C@@H]1CCC[C@@H]1F MCULE-5918995947 [0,1,0,1,0,0|2,0,0]=4 4986 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-3619202671 [0,1,0,1,0,0|1,0,0]=3 4987 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-5588562063 [0,1,0,1,0,0|1,0,0]=3 4988 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-8937650915 [0,1,0,1,0,0|1,0,0]=3 4989 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9550479411 [0,1,0,1,0,0|1,0,0]=3 4990 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9908988904 [0,1,0,1,0,0|1,0,0]=3 4991 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-1389039924 [0,1,0,1,0,0|2,0,0]=4 4992 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-2197861570 [0,1,0,1,0,0|2,0,0]=4 4993 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-3318849776 [0,1,0,1,0,0|2,0,0]=4 4994 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-5395257521 [0,1,0,1,0,0|2,0,0]=4 4995 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-8318262942 [0,1,0,1,0,0|2,0,0]=4 4996 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-9877401480 [0,1,0,1,0,0|2,0,0]=4 4997 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-1630250066 [0,1,0,1,0,0|2,0,0]=4 4998 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5738867214 [0,1,0,1,0,0|2,0,0]=4 4999 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5794367720 [0,1,0,1,0,0|2,0,0]=4 5000 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-6079002018 [0,1,0,1,0,0|2,0,0]=4 5001 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7332231839 [0,1,0,1,0,0|2,0,0]=4 5002 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7604406385 [0,1,0,1,0,0|2,0,0]=4 5003 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-2283352070 [0,1,0,1,0,0|1,0,0]=3 5004 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-3279782742 [0,1,0,1,0,0|1,0,0]=3 5005 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-6823698796 [0,1,0,1,0,0|1,0,0]=3 5006 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-7752087047 [0,1,0,1,0,0|1,0,0]=3 5007 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-8823714511 [0,1,0,1,0,0|1,0,0]=3 5008 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-9789739251 [0,1,0,1,0,0|1,0,0]=3 5009 B7R1.4 N[C@@H]1CCOC1=O MCULE-1027751896 [0,1,0,1,0,0|1,0,1]=4 5010 B7R1.4 N[C@@H]1CCOC1=O MCULE-4034349263 [0,1,0,1,0,0|1,0,1]=4 5011 B7R1.4 N[C@@H]1CCOC1=O MCULE-8790782772 [0,1,0,1,0,0|1,0,1]=4 5012 B7R1.4 N[C@@H]1CCOC1=O MCULE-9300265861 [0,1,0,1,0,0|1,0,1]=4 5013 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-1708344428 [0,1,0,1,0,0|2,0,0]=4 5014 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-3614628548 [0,1,0,1,0,0|2,0,0]=4 5015 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-5868430910 [0,1,0,1,0,0|2,0,0]=4 5016 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-9283549047 [0,1,0,1,0,0|2,0,0]=4 5017 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-1582887664 [0,1,0,1,0,0|1,0,0]=3 5018 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-3978694929 [0,1,0,1,0,0|1,0,0]=3 5019 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-4503972605 [0,1,0,1,0,0|1,0,0]=3 5020 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-6640537480 [0,1,0,1,0,0|1,0,0]=3 5021 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5625344145 [0,1,0,1,0,0|1,0,0]=3 5022 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5743565778 [0,1,0,1,0,0|1,0,0]=3 5023 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-7916026303 [0,1,0,1,0,0|1,0,0]=3 5024 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [0,1,0,1,0,0|0,0,0]=2 5025 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [0,1,0,1,0,0|0,0,0]=2 5026 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3183837574 [0,1,0,1,0,0|1,0,0]=3 5027 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3329511858 [0,1,0,1,0,0|1,0,0]=3 5028 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3234416434 [0,1,0,1,0,0|1,0,0]=3 5029 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3421021007 [0,1,0,1,0,0|1,0,0]=3 5030 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [0,1,0,1,0,0|0,0,0]=2 5031 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [0,1,0,1,0,0|0,0,0]=2 5032 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [0,1,0,1,0,0|0,0,0]=2 5033 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [0,1,0,1,0,0|0,0,0]=2 5034 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [0,1,0,1,0,0|0,0,0]=2 5035 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [0,1,0,1,0,0|0,0,0]=2 5036 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-4507133192 [0,1,0,1,0,0|0,1,0]=3 5037 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-9327920188 [0,1,0,1,0,0|0,1,0]=3 5038 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-5323319055 [0,1,0,1,0,0|0,1,0]=3 5039 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-8008053411 [0,1,0,1,0,0|0,1,0]=3 5040 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-6629056296 [0,1,0,1,0,0|1,0,0]=3 5041 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-7682114350 [0,1,0,1,0,0|1,0,0]=3 5042 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-8554796061 [0,1,0,1,0,0|1,0,0]=3 5043 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-9329258920 [0,1,0,1,0,0|1,0,0]=3 5044 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-1361897949 [0,1,0,1,0,0|2,0,0]=4 5045 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-4545374374 [0,1,0,1,0,0|2,0,0]=4 5046 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-1156997833 [0,1,0,1,0,0|1,0,0]=3 5047 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-2524879699 [0,1,0,1,0,0|1,0,0]=3 5048 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-7034968971 [0,1,0,1,0,0|1,0,0]=3 5049 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9262461574 [0,1,0,1,0,0|1,0,0]=3 5050 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9904485750 [0,1,0,1,0,0|1,0,0]=3 5051 B7R1.4 N[C@H]1CCOC1=O MCULE-4393293388 [0,1,0,1,0,0|1,0,1]=4 5052 B7R1.4 N[C@H]1CCOC1=O MCULE-4751602783 [0,1,0,1,0,0|1,0,1]=4 5053 B7R1.4 N[C@H]1CCOC1=O MCULE-7924572479 [0,1,0,1,0,0|1,0,1]=4 5054 B7R1.4 N[C@H]1CCOC1=O MCULE-8545644747 [0,1,0,1,0,0|1,0,1]=4 5055 B7R1.4 N[C@H]1CCOC1=O MCULE-8634641228 [0,1,0,1,0,0|1,0,1]=4 5056 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-1031359839 [0,1,0,1,0,0|1,0,0]=3 5057 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-6239060869 [0,1,0,1,0,0|1,0,0]=3 5058 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-4495433095 [0,1,0,1,0,0|1,0,0]=3 5059 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-6217406845 [0,1,0,1,0,0|1,0,0]=3 5060 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-9762071646 [0,1,0,1,0,0|1,0,0]=3 5061 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [0,1,0,1,0,0|0,0,0]=2 5062 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [0,1,0,1,0,0|0,0,0]=2 5063 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [0,1,0,1,0,0|0,0,0]=2 5064 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [0,1,0,1,0,0|0,0,0]=2 5065 B7R1.4 N[C@H]1COC[C@H]1F MCULE-7980939593 [0,1,0,1,0,0|1,0,0]=3 5066 B7R1.4 N[C@H]1COC[C@H]1F MCULE-8990550970 [0,1,0,1,0,0|1,0,0]=3 5067 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [0,1,0,1,0,0|0,0,0]=2 5068 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [0,1,0,1,0,0|0,0,0]=2 5069 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [0,1,0,1,0,0|0,0,0]=2 5070 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [0,1,0,1,0,0|0,0,0]=2 5071 B7R1.4 O=C1CCCC1O MCULE-6795188798 [0,1,0,1,0,0|1,0,1]=4 5072 B7R1.4 O=C1NCCC1O MCULE-8818841339 [0,1,0,1,0,0|1,0,1]=4 5073 B7R1.4 O=C1NCCC1O MCULE-9662824811 [0,1,0,1,0,0|1,0,1]=4 5074 B7R1.4 O=C1NCC[C@@H]1O MCULE-3212474164 [0,1,0,1,0,0|1,0,1]=4 5075 B7R1.4 O=C1NCC[C@@H]1O MCULE-7816291255 [0,1,0,1,0,0|1,0,1]=4 5076 B7R1.4 O=C1NCC[C@H]1O MCULE-1281835510 [0,1,0,1,0,0|1,0,1]=4 5077 B7R1.4 O=C1NCC[C@H]1O MCULE-6809356348 [0,1,0,1,0,0|1,0,1]=4 5078 B7R1.4 O=C1OCCC1Br MCULE-8316114331 [0,1,0,1,0,0|1,0,1]=4 5079 B7R1.4 O=C1OCCC1O MCULE-2144002601 [0,1,0,1,0,0|0,0,1]=3 5080 B7R1.4 O=C1OCCC1S MCULE-2130434062 [0,1,0,1,0,0|0,1,1]=4 5081 B7R1.4 O=C1OCC[C@@H]1O MCULE-7764011790 [0,1,0,1,0,0|0,0,1]=3 5082 B7R1.4 O=C1OCC[C@@H]1O MCULE-9001729998 [0,1,0,1,0,0|0,0,1]=3 5083 B7R1.4 O=C1OCC[C@H]1O MCULE-6949645282 [0,1,0,1,0,0|0,0,1]=3 5084 B7R1.4 O=C1OCC[C@H]1O MCULE-7110242636 [0,1,0,1,0,0|0,0,1]=3 5085 B7R1.4 OC1CCC=C1Br MCULE-2577502971 [0,1,0,1,0,0|1,0,1]=4 5086 B7R1.4 OC1CCCC1Br MCULE-9027030471 [0,1,0,1,0,0|1,0,0]=3 5087 B7R1.4 OC1CCCC1Cl MCULE-5561130140 [0,1,0,1,0,0|1,0,0]=3 5088 B7R1.4 OC1CCCC1F MCULE-9111039481 [0,1,0,1,0,0|1,0,0]=3 5089 B7R1.4 OC1CCCC1O MCULE-2003945768 [0,1,0,1,0,0|1,0,0]=3 5090 B7R1.4 OC1CNCC1Br MCULE-1241091506 [0,1,0,1,0,0|1,0,0]=3 5091 B7R1.4 OC1CNCC1Br MCULE-4889737174 [0,1,0,1,0,0|1,0,0]=3 5092 B7R1.4 OC1CNCC1F MCULE-3412240528 [0,1,0,1,0,0|1,0,0]=3 5093 B7R1.4 OC1CNCC1F MCULE-7214807363 [0,1,0,1,0,0|1,0,0]=3 5094 B7R1.4 OC1CNCC1O MCULE-4416566731 [0,1,0,1,0,0|1,0,0]=3 5095 B7R1.4 OC1CNCC1O MCULE-7287658845 [0,1,0,1,0,0|1,0,0]=3 5096 B7R1.4 OC1COCC1Br MCULE-8642236751 [0,1,0,1,0,0|0,0,0]=2 5097 B7R1.4 OC1COCC1F MCULE-3255803142 [0,1,0,1,0,0|0,0,0]=2 5098 B7R1.4 OC1COCC1O MCULE-2982401803 [0,1,0,1,0,0|0,0,0]=2 5099 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-5851051143 [0,1,0,1,0,0|1,0,0]=3 5100 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-6816188915 [0,1,0,1,0,0|1,0,0]=3 5101 B7R1.4 O[C@@H]1CCC[C@H]1F MCULE-6825738824 [0,1,0,1,0,0|1,0,0]=3 5102 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-3171045763 [0,1,0,1,0,0|1,0,0]=3 5103 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-4369287998 [0,1,0,1,0,0|1,0,0]=3 5104 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-4544085940 [0,1,0,1,0,0|1,0,0]=3 5105 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-6356393045 [0,1,0,1,0,0|1,0,0]=3 5106 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-7332143154 [0,1,0,1,0,0|1,0,0]=3 5107 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8032995983 [0,1,0,1,0,0|1,0,0]=3 5108 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8052505932 [0,1,0,1,0,0|1,0,0]=3 5109 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8564653401 [0,1,0,1,0,0|1,0,0]=3 5110 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-2691246784 [0,1,0,1,0,0|1,0,0]=3 5111 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-7250968554 [0,1,0,1,0,0|1,0,0]=3 5112 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8439784112 [0,1,0,1,0,0|1,0,0]=3 5113 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8682802807 [0,1,0,1,0,0|1,0,0]=3 5114 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-2199886254 [0,1,0,1,0,0|1,0,0]=3 5115 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-3341203076 [0,1,0,1,0,0|1,0,0]=3 5116 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-5521619072 [0,1,0,1,0,0|1,0,0]=3 5117 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [0,1,0,1,0,0|0,0,0]=2 5118 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [0,1,0,1,0,0|0,0,0]=2 5119 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [0,1,0,1,0,0|0,0,0]=2 5120 B7R1.4 O[C@H]1CCC[C@@H]1F MCULE-5487297072 [0,1,0,1,0,0|1,0,0]=3 5121 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4051443060 [0,1,0,1,0,0|1,0,0]=3 5122 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4644231649 [0,1,0,1,0,0|1,0,0]=3 5123 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-6847877597 [0,1,0,1,0,0|1,0,0]=3 5124 B7R1.4 O[C@H]1CCC[C@H]1Br MCULE-2758354858 [0,1,0,1,0,0|1,0,0]=3 5125 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-6157730443 [0,1,0,1,0,0|1,0,0]=3 5126 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-8785327416 [0,1,0,1,0,0|1,0,0]=3 5127 B7R1.4 O[C@H]1CCC[C@H]1O MCULE-7305350842 [0,1,0,1,0,0|1,0,0]=3 5128 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-3839318633 [0,1,0,1,0,0|1,0,0]=3 5129 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-4218821429 [0,1,0,1,0,0|1,0,0]=3 5130 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-7845583982 [0,1,0,1,0,0|1,0,0]=3 5131 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-9325791348 [0,1,0,1,0,0|1,0,0]=3 5132 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-5585016580 [0,1,0,1,0,0|1,0,0]=3 5133 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-6252837981 [0,1,0,1,0,0|1,0,0]=3 5134 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-7474807017 [0,1,0,1,0,0|1,0,0]=3 5135 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-8814174366 [0,1,0,1,0,0|1,0,0]=3 5136 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-9936814184 [0,1,0,1,0,0|1,0,0]=3 5137 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-2104048645 [0,1,0,1,0,0|1,0,0]=3 5138 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5086480017 [0,1,0,1,0,0|1,0,0]=3 5139 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5328004683 [0,1,0,1,0,0|1,0,0]=3 5140 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5990996560 [0,1,0,1,0,0|1,0,0]=3 5141 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-8087937166 [0,1,0,1,0,0|1,0,0]=3 5142 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-9522092804 [0,1,0,1,0,0|1,0,0]=3 5143 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [0,1,0,1,0,0|0,0,0]=2 5144 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [0,1,0,1,0,0|0,0,0]=2 5145 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [0,1,0,1,0,0|0,0,0]=2 5146 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [0,1,0,1,0,0|0,0,0]=2 5147 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [0,1,0,1,0,0|2,0,0]=4 5148 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [0,1,0,1,0,0|2,0,0]=4 5149 B7R1.4 [C@@H]1(CCC[C@H]1N)F MCULE-5545998720 [0,1,0,1,0,0|2,0,0]=4 5150 B7R1.4 [C@@H]1(CNC[C@@H]1O)O MCULE-2661544949 [0,1,0,1,0,0|1,0,0]=3 5151 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-3635591654 [0,1,0,1,0,0|1,0,0]=3 5152 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-5914925477 [0,1,0,1,0,0|1,0,0]=3 5153 B7R1.4 [C@@H]1(COC[C@@H]1N)N MCULE-4324328112 [0,1,0,1,0,0|1,0,0]=3 5154 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-1484680203 [0,1,0,1,0,0|1,0,0]=3 5155 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-7754900549 [0,1,0,1,0,0|1,0,0]=3 5156 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-5920046767 [0,1,0,1,0,0|1,0,0]=3 5157 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-6282053067 [0,1,0,1,0,0|1,0,0]=3 5158 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-8432332245 [0,1,0,1,0,0|1,0,0]=3 5159 B7R1.4 [NH3+][C@@H]1CSC[C@@H]1O MCULE-5747970201 [0,1,0,1,0,0|0,1,0]=3 5160 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O MCULE-4897701746 [0,1,0,1,0,0|0,1,0]=3 5161 B7R1.4 [NH3+][C@H]1CCOC1=O MCULE-8903471982 [0,1,0,1,0,0|1,0,1]=4 5162 B7R1.5 CCCC1CC1N MCULE-6204339829 [0,1,0,1,0,0|2,0,0]=4 5163 B7R1.5 CCCC1ON1C MCULE-8959342998 [0,1,0,1,0,0|2,0,0]=4 5164 B7R1.5 CCOC1CC1N MCULE-1141331549 [0,1,0,1,0,0|1,0,0]=3 5165 B7R1.5 CNCC1CC1C MCULE-9748636910 [0,1,0,1,0,0|2,0,0]=4 5166 B7R1.6 BrCCC1CCC1 MCULE-8124070706 [0,1,0,1,0,0|2,0,0]=4 5167 B7R1.6 BrCCC1CCO1 MCULE-2777479085 [0,1,0,1,0,0|1,0,0]=3 5168 B7R1.6 BrCCC1COC1 MCULE-8858681111 [0,1,0,1,0,0|2,0,0]=4 5169 B7R1.6 BrCCN1CCC1 MCULE-1886791890 [0,1,0,1,0,0|2,0,0]=4 5170 B7R1.6 BrCCN1CCC1 MCULE-2174275052 [0,1,0,1,0,0|2,0,0]=4 5171 B7R1.6 C1(CCN1)COC MCULE-6891607313 [0,1,0,1,0,0|1,0,0]=3 5172 B7R1.6 CCCC1CCN1 MCULE-7330412999 [0,1,0,1,0,0|2,0,0]=4 5173 B7R1.6 CCCC1CNC1 MCULE-4374477641 [0,1,0,1,0,0|2,0,0]=4 5174 B7R1.6 CCCC1CNC1 MCULE-8036298863 [0,1,0,1,0,0|2,0,0]=4 5175 B7R1.6 CCNC1CCC1 MCULE-2055959297 [0,1,0,1,0,0|2,0,0]=4 5176 B7R1.6 CCNC1CCC1 MCULE-2989731173 [0,1,0,1,0,0|2,0,0]=4 5177 B7R1.6 CCNC1CNC1 MCULE-3810334615 [0,1,0,1,0,0|2,0,0]=4 5178 B7R1.6 CCNC1CNC1 MCULE-3811754191 [0,1,0,1,0,0|2,0,0]=4 5179 B7R1.6 CCNC1COC1 MCULE-6357248771 [0,1,0,1,0,0|1,0,0]=3 5180 B7R1.6 CCNC1COC1 MCULE-8144856469 [0,1,0,1,0,0|1,0,0]=3 5181 B7R1.6 CCOC1CNC1 MCULE-5408347465 [0,1,0,1,0,0|1,0,0]=3 5182 B7R1.6 CCOC1CNC1 MCULE-5853062591 [0,1,0,1,0,0|1,0,0]=3 5183 B7R1.6 CCOC1CNC1 MCULE-7457457501 [0,1,0,1,0,0|1,0,0]=3 5184 B7R1.6 CCOC1CNC1 MCULE-9277972796 [0,1,0,1,0,0|1,0,0]=3 5185 B7R1.6 CNCC1CCC1 MCULE-3632390845 [0,1,0,1,0,0|2,0,0]=4 5186 B7R1.6 CNCC1CCC1 MCULE-4932211047 [0,1,0,1,0,0|2,0,0]=4 5187 B7R1.6 CNCC1CCO1 MCULE-5990606434 [0,1,0,1,0,0|1,0,0]=3 5188 B7R1.6 CNCC1COC1 MCULE-9048388624 [0,1,0,1,0,0|2,0,0]=4 5189 B7R1.6 COCC1CCN1 MCULE-3275131561 [0,1,0,1,0,0|1,0,0]=3 5190 B7R1.6 COCC1CCN1 MCULE-4183304984 [0,1,0,1,0,0|1,0,0]=3 5191 B7R1.6 COCC1CCN1 MCULE-7159192750 [0,1,0,1,0,0|1,0,0]=3 5192 B7R1.6 COCC1CNC1 MCULE-4967592714 [0,1,0,1,0,0|2,0,0]=4 5193 B7R1.6 COCC1CNC1 MCULE-6804867712 [0,1,0,1,0,0|2,0,0]=4 5194 B7R1.6 COCC1CNC1 MCULE-9862500955 [0,1,0,1,0,0|2,0,0]=4 5195 B7R1.6 COC[C@@H]1CCN1 MCULE-2241257059 [0,1,0,1,0,0|1,0,0]=3 5196 B7R1.6 COC[C@@H]1CCN1 MCULE-4677436919 [0,1,0,1,0,0|1,0,0]=3 5197 B7R1.6 COC[C@@H]1CCN1 MCULE-5280330847 [0,1,0,1,0,0|1,0,0]=3 5198 B7R1.6 COC[C@@H]1CCN1 MCULE-9466463613 [0,1,0,1,0,0|1,0,0]=3 5199 B7R1.6 COC[C@H]1CCN1 MCULE-7456820187 [0,1,0,1,0,0|1,0,0]=3 5200 B7R1.6 COC[C@H]1CCN1 MCULE-7652894052 [0,1,0,1,0,0|1,0,0]=3 5201 B7R1.6 ClCCN1CCC1 MCULE-1047861643 [0,1,0,1,0,0|2,0,0]=4 5202 B7R1.6 ClCCN1CCC1 MCULE-8627041760 [0,1,0,1,0,0|2,0,0]=4 5203 B7R1.6 ClCOC1CCC1 MCULE-3275885126 [0,1,0,1,0,0|2,0,0]=4 5204 B7R1.6 ICCC1CCO1 MCULE-3778448773 [0,1,0,1,0,0|1,0,0]=3 5205 B7R1.6 ICCC1COC1 MCULE-6063305860 [0,1,0,1,0,0|2,0,0]=4 5206 B7R1.6 N#CCC1CCC1 MCULE-6463664417 [0,1,0,1,0,0|2,0,0]=4 5207 B7R1.6 NCCC1CCC1 MCULE-2620603238 [0,1,0,1,0,0|2,0,0]=4 5208 B7R1.6 NCCC1CCC1 MCULE-8653518690 [0,1,0,1,0,0|2,0,0]=4 5209 B7R1.6 NCCC1CCO1 MCULE-3619983020 [0,1,0,1,0,0|1,0,0]=3 5210 B7R1.6 NCCC1CNC1 MCULE-7195412134 [0,1,0,1,0,0|2,0,0]=4 5211 B7R1.6 NCCC1COC1 MCULE-6363254952 [0,1,0,1,0,0|2,0,0]=4 5212 B7R1.6 NCCC1COC1 MCULE-6907504739 [0,1,0,1,0,0|2,0,0]=4 5213 B7R1.6 NCCC1CSC1 MCULE-5034757527 [0,1,0,1,0,0|2,0,0]=4 5214 B7R1.6 NCCN1CCC1 MCULE-8622841145 [0,1,0,1,0,0|2,0,0]=4 5215 B7R1.6 NCC[C@@H]1CCO1 MCULE-5442768835 [0,1,0,1,0,0|1,0,0]=3 5216 B7R1.6 NNCC1CCC1 MCULE-1501882161 [0,1,0,1,0,0|2,0,0]=4 5217 B7R1.6 NNCC1CCC1 MCULE-2534970700 [0,1,0,1,0,0|2,0,0]=4 5218 B7R1.6 NNCC1CCC1 MCULE-3026467418 [0,1,0,1,0,0|2,0,0]=4 5219 B7R1.6 NOCC1CCC1 MCULE-1477129462 [0,1,0,1,0,0|1,0,0]=3 5220 B7R1.6 NOCC1CCC1 MCULE-7638467520 [0,1,0,1,0,0|1,0,0]=3 5221 B7R1.6 O=CCC1CCC1 MCULE-6234957728 [0,1,0,1,0,0|1,0,1]=4 5222 B7R1.6 OCCC1CCC1 MCULE-1014969390 [0,1,0,1,0,0|1,0,0]=3 5223 B7R1.6 OCCC1CCN1 MCULE-4368379502 [0,1,0,1,0,0|1,0,0]=3 5224 B7R1.6 OCCC1CCO1 MCULE-3323265996 [0,1,0,1,0,0|0,0,0]=2 5225 B7R1.6 OCCC1CNC1 MCULE-1975411420 [0,1,0,1,0,0|1,0,0]=3 5226 B7R1.6 OCCC1CNC1 MCULE-4993890888 [0,1,0,1,0,0|1,0,0]=3 5227 B7R1.6 OCCC1COC1 MCULE-2515762048 [0,1,0,1,0,0|1,0,0]=3 5228 B7R1.6 OCCN1CCC1 MCULE-5517552533 [0,1,0,1,0,0|1,0,0]=3 5229 B7R1.6 OCC[C@@H]1CCN1 MCULE-9567198532 [0,1,0,1,0,0|1,0,0]=3 5230 B7R1.6 OCC[C@@H]1CCO1 MCULE-6606073727 [0,1,0,1,0,0|0,0,0]=2 5231 B7R1.6 OCC[C@H]1CCN1 MCULE-7385668340 [0,1,0,1,0,0|1,0,0]=3 5232 B7R1.6 OCC[C@H]1CCO1 MCULE-4848994972 [0,1,0,1,0,0|0,0,0]=2 5233 B7R1.6 OCC[C@H]1CCO1 MCULE-9787306242 [0,1,0,1,0,0|0,0,0]=2 5234 B7R1.8 CC1CCC1C=O MCULE-9541644884 [0,1,0,1,0,0|1,0,1]=4 5235 B7R1.8 CC1CCC1CO MCULE-4677269341 [0,1,0,1,0,0|1,0,0]=3 5236 B7R1.8 CC1NCC1C#N MCULE-4737687321 [0,1,0,1,0,0|2,0,0]=4 5237 B7R1.8 CC1NCC1C#N MCULE-5845745422 [0,1,0,1,0,0|2,0,0]=4 5238 B7R1.8 CCC1CCC1=O MCULE-5109615435 [0,1,0,1,0,0|1,0,1]=4 5239 B7R1.8 CN1CCC1CN MCULE-2100632643 [0,1,0,1,0,0|2,0,0]=4 5240 B7R1.8 CN1CCC1CN MCULE-3660614289 [0,1,0,1,0,0|2,0,0]=4 5241 B7R1.8 CN1CCC1CN MCULE-3692131671 [0,1,0,1,0,0|2,0,0]=4 5242 B7R1.8 CN1CCC1CN MCULE-7629527689 [0,1,0,1,0,0|2,0,0]=4 5243 B7R1.8 CN1CCC1CO MCULE-3475629266 [0,1,0,1,0,0|1,0,0]=3 5244 B7R1.8 CN1CC[C@@H]1CN MCULE-3688982926 [0,1,0,1,0,0|2,0,0]=4 5245 B7R1.8 CN1CC[C@@H]1CN MCULE-5002925247 [0,1,0,1,0,0|2,0,0]=4 5246 B7R1.8 CN1CC[C@@H]1CN MCULE-7546481794 [0,1,0,1,0,0|2,0,0]=4 5247 B7R1.8 CN1CC[C@@H]1CO MCULE-2590783241 [0,1,0,1,0,0|1,0,0]=3 5248 B7R1.8 CN1CC[C@@H]1CO MCULE-9683847113 [0,1,0,1,0,0|1,0,0]=3 5249 B7R1.8 CN1CC[C@H]1CN MCULE-1178047911 [0,1,0,1,0,0|2,0,0]=4 5250 B7R1.8 CN1CC[C@H]1CN MCULE-1250398573 [0,1,0,1,0,0|2,0,0]=4 5251 B7R1.8 CN1CC[C@H]1CN MCULE-2733818158 [0,1,0,1,0,0|2,0,0]=4 5252 B7R1.8 CN1CC[C@H]1CN MCULE-4100743401 [0,1,0,1,0,0|2,0,0]=4 5253 B7R1.8 CN1CC[C@H]1CN MCULE-4459814320 [0,1,0,1,0,0|2,0,0]=4 5254 B7R1.8 CN1CC[C@H]1CN MCULE-4703409645 [0,1,0,1,0,0|2,0,0]=4 5255 B7R1.8 CN1CC[C@H]1CN MCULE-6317046346 [0,1,0,1,0,0|2,0,0]=4 5256 B7R1.8 CN1CC[C@H]1CN MCULE-7413844263 [0,1,0,1,0,0|2,0,0]=4 5257 B7R1.8 CN1CC[C@H]1CO MCULE-6507300625 [0,1,0,1,0,0|1,0,0]=3 5258 B7R1.8 CN1CC[C@H]1CO MCULE-9641004134 [0,1,0,1,0,0|1,0,0]=3 5259 B7R1.8 CN[C@H]1CC[C@@H]1O MCULE-4638367588 [0,1,0,1,0,0|1,0,0]=3 5260 B7R1.8 COC1CCC1N MCULE-4537411385 [0,1,0,1,0,0|2,0,0]=4 5261 B7R1.8 COC1CCC1N MCULE-6423037026 [0,1,0,1,0,0|2,0,0]=4 5262 B7R1.8 CO[C@@H]1CC[C@@H]1N MCULE-3087283983 [0,1,0,1,0,0|2,0,0]=4 5263 B7R1.8 CO[C@@H]1CC[C@@H]1N MCULE-8723342484 [0,1,0,1,0,0|2,0,0]=4 5264 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-1324573121 [0,1,0,1,0,0|2,0,0]=4 5265 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-4430321170 [0,1,0,1,0,0|2,0,0]=4 5266 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-4876260929 [0,1,0,1,0,0|2,0,0]=4 5267 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-5060858396 [0,1,0,1,0,0|2,0,0]=4 5268 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-5711735047 [0,1,0,1,0,0|2,0,0]=4 5269 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-9952102635 [0,1,0,1,0,0|2,0,0]=4 5270 B7R1.8 CO[C@H]1CC[C@@H]1N MCULE-2991866514 [0,1,0,1,0,0|2,0,0]=4 5271 B7R1.8 CO[C@H]1CC[C@@H]1N MCULE-9729569658 [0,1,0,1,0,0|2,0,0]=4 5272 B7R1.8 CO[C@H]1CC[C@H]1N MCULE-9859722305 [0,1,0,1,0,0|2,0,0]=4 5273 B7R1.8 CO[C@H]1CC[C@H]1N MCULE-9948570347 [0,1,0,1,0,0|2,0,0]=4 5274 B7R1.8 NCC1CCC1F MCULE-6621673772 [0,1,0,1,0,0|2,0,0]=4 5275 B7R1.8 NCC1CCC1F MCULE-8982565541 [0,1,0,1,0,0|2,0,0]=4 5276 B7R1.8 O=C1CCC1CO MCULE-5501600764 [0,1,0,1,0,0|1,0,0]=3 5277 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [0,1,0,1,0,0|1,0,0]=3 5278 B7R1.8 OCC1CCC1F MCULE-2481035584 [0,1,0,1,0,0|1,0,0]=3 5279 B7R1.8 OCC1CCC1O MCULE-9764745395 [0,1,0,1,0,0|1,0,0]=3 5280 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [0,1,0,1,0,0|1,0,0]=3 5281 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [0,1,0,1,0,0|1,0,0]=3 5282 B7R1.9 C#CC1CC1CO MCULE-9506693915 [0,1,0,1,0,0|1,0,1]=4 5283 B7R1.9 C#C[C@H]1C[C@H]1CO MCULE-5176741676 [0,1,0,1,0,0|1,0,1]=4 5284 B7R1.9 CCC1CC1CN MCULE-6264158284 [0,1,0,1,0,0|2,0,0]=4 5285 B7R1.9 CCC1CC1CN MCULE-7047201371 [0,1,0,1,0,0|2,0,0]=4 5286 B7R1.9 CCC1CC1CO MCULE-3342087238 [0,1,0,1,0,0|1,0,0]=3 5287 B7R1.9 N#CC1CC1CO MCULE-7679796035 [0,1,0,1,0,0|1,0,1]=4 5288 B7R1.9 NCC1CC1CN MCULE-2708697512 [0,1,0,1,0,0|2,0,0]=4 5289 B7R1.9 NCC1CC1CN MCULE-8017169356 [0,1,0,1,0,0|2,0,0]=4 5290 B7R1.9 NCC1CC1CO MCULE-2679526126 [0,1,0,1,0,0|1,0,0]=3 5291 B7R1.9 NC[C@@H]1C[C@H]1CN MCULE-1460900772 [0,1,0,1,0,0|2,0,0]=4 5292 B7R1.9 NC[C@@H]1C[C@H]1CN MCULE-5609779965 [0,1,0,1,0,0|2,0,0]=4 5293 B7R1.9 NC[C@H]1C[C@@H]1CO MCULE-4100547975 [0,1,0,1,0,0|1,0,0]=3 5294 B7R1.9 NC[C@H]1C[C@H]1CN MCULE-4880621233 [0,1,0,1,0,0|2,0,0]=4 5295 B7R1.9 NC[C@H]1C[C@H]1CN MCULE-9980954134 [0,1,0,1,0,0|2,0,0]=4 5296 B7R1.9 NC[C@H]1C[C@H]1CO MCULE-4756509186 [0,1,0,1,0,0|1,0,0]=3 5297 B7R1.9 OCC1CC1CO MCULE-5153064657 [0,1,0,1,0,0|1,0,0]=3 5298 B7R1.9 OC[C@H]1C[C@H]1CO MCULE-9036138013 [0,1,0,1,0,0|1,0,0]=3 5299 B7R1.10 C=C1CC(C1)CO MCULE-6295731045 [0,1,0,1,0,0|1,0,1]=4 5300 B7R1.10 CC1CC(C1)CBr MCULE-3814375250 [0,1,0,1,0,0|2,0,0]=4 5301 B7R1.10 CC1CC(C1)CN MCULE-4821587591 [0,1,0,1,0,0|2,0,0]=4 5302 B7R1.10 CC1CC(C1)CN MCULE-8372628495 [0,1,0,1,0,0|2,0,0]=4 5303 B7R1.10 CC1CC(C1)CO MCULE-5730978355 [0,1,0,1,0,0|1,0,0]=3 5304 B7R1.10 CCN1CC(C1)N MCULE-5174054363 [0,1,0,1,0,0|2,0,0]=4 5305 B7R1.10 CCN1CC(C1)N MCULE-9292929070 [0,1,0,1,0,0|2,0,0]=4 5306 B7R1.10 CCN1CC(C1)O MCULE-6471655695 [0,1,0,1,0,0|1,0,0]=3 5307 B7R1.10 CCN1CC(C1)O MCULE-9317904836 [0,1,0,1,0,0|1,0,0]=3 5308 B7R1.10 CN1CC(C1)CO MCULE-7263385340 [0,1,0,1,0,0|2,0,0]=4 5309 B7R1.10 CN1CC(C1)CO MCULE-8892079014 [0,1,0,1,0,0|2,0,0]=4 5310 B7R1.10 CNC1CC(C1)O MCULE-1360972312 [0,1,0,1,0,0|2,0,0]=4 5311 B7R1.10 CNC1CC(C1)O MCULE-1798280109 [0,1,0,1,0,0|2,0,0]=4 5312 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-2573139583 [0,1,0,1,0,0|2,0,0]=4 5313 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-8240672064 [0,1,0,1,0,0|2,0,0]=4 5314 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-1676114682 [0,1,0,1,0,0|2,0,0]=4 5315 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-5219886186 [0,1,0,1,0,0|2,0,0]=4 5316 B7R1.10 COC1CC(C1)O MCULE-6762585493 [0,1,0,1,0,0|2,0,0]=4 5317 B7R1.10 CO[C@H]1C[C@@H](C1)O MCULE-8355585959 [0,1,0,1,0,0|2,0,0]=4 5318 B7R1.10 CO[C@H]1C[C@H](C1)O MCULE-4960775262 [0,1,0,1,0,0|2,0,0]=4 5319 B7R1.10 CSC1CC(C1)O MCULE-1605912153 [0,1,0,1,0,0|2,0,0]=4 5320 B7R1.10 NC1CC(C1)CO MCULE-4549811698 [0,1,0,1,0,0|1,0,0]=3 5321 B7R1.10 NC1CC(C1)CO MCULE-9310533439 [0,1,0,1,0,0|1,0,0]=3 5322 B7R1.10 NCC1CC(C1)F MCULE-8395280530 [0,1,0,1,0,0|2,0,0]=4 5323 B7R1.10 NCC1CC(C1)F MCULE-9102367552 [0,1,0,1,0,0|2,0,0]=4 5324 B7R1.10 NCC1CC(C1)O MCULE-1448807479 [0,1,0,1,0,0|2,0,0]=4 5325 B7R1.10 NCC1CC(C1)O MCULE-5095960848 [0,1,0,1,0,0|2,0,0]=4 5326 B7R1.10 NC[C@H]1C[C@@H](C1)F MCULE-5013421604 [0,1,0,1,0,0|2,0,0]=4 5327 B7R1.10 NC[C@H]1C[C@@H](C1)F MCULE-9543558044 [0,1,0,1,0,0|2,0,0]=4 5328 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-2155101378 [0,1,0,1,0,0|2,0,0]=4 5329 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-3237212031 [0,1,0,1,0,0|2,0,0]=4 5330 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-3137766844 [0,1,0,1,0,0|2,0,0]=4 5331 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-6173771659 [0,1,0,1,0,0|2,0,0]=4 5332 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-1976271596 [0,1,0,1,0,0|1,0,0]=3 5333 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-2004610084 [0,1,0,1,0,0|1,0,0]=3 5334 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-3406959231 [0,1,0,1,0,0|1,0,0]=3 5335 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-9771399616 [0,1,0,1,0,0|1,0,0]=3 5336 B7R1.10 O=C1CC(C1)CO MCULE-6785243243 [0,1,0,1,0,0|1,0,1]=4 5337 B7R1.10 O=C1CC(N1)CO MCULE-5966757004 [0,1,0,1,0,0|1,0,1]=4 5338 B7R1.10 O=C1CC(N1)CO MCULE-7672639952 [0,1,0,1,0,0|1,0,1]=4 5339 B7R1.10 O=C1CC(O1)CBr MCULE-1451058371 [0,1,0,1,0,0|1,0,1]=4 5340 B7R1.10 O=C1C[C@@H](N1)CO MCULE-7235908958 [0,1,0,1,0,0|1,0,1]=4 5341 B7R1.10 O=C1C[C@@H](N1)CO MCULE-9940834935 [0,1,0,1,0,0|1,0,1]=4 5342 B7R1.10 O=C1C[C@H](N1)CO MCULE-1643787736 [0,1,0,1,0,0|1,0,1]=4 5343 B7R1.10 OC1CC(C1)CBr MCULE-8641406432 [0,1,0,1,0,0|2,0,0]=4 5344 B7R1.10 OC1CC(C1)CF MCULE-9152872996 [0,1,0,1,0,0|2,0,0]=4 5345 B7R1.10 OCC1CC(C1)Br MCULE-6426656913 [0,1,0,1,0,0|1,0,0]=3 5346 B7R1.10 OCC1CC(C1)Cl MCULE-8102550006 [0,1,0,1,0,0|1,0,0]=3 5347 B7R1.10 OCC1CC(C1)F MCULE-8343173774 [0,1,0,1,0,0|1,0,0]=3 5348 B7R1.10 OCC1CC(C1)O MCULE-3885216336 [0,1,0,1,0,0|1,0,0]=3 5349 B7R1.10 OC[C@H]1C[C@H](C1)O MCULE-2350233032 [0,1,0,1,0,0|1,0,0]=3 5350 B7R1.10 O[C@H]1C[C@H](C1)CF MCULE-2417083162 [0,1,0,1,0,0|2,0,0]=4 5351 B7R1.10 [C@@H]1(C[C@H](C1)CN)F MCULE-1449288209 [0,1,0,1,0,0|2,0,0]=4 5352 B7R1.10 [C@@H]1(C[C@H](C1)CN)F MCULE-2879792720 [0,1,0,1,0,0|2,0,0]=4 5353 B7R1.15 CC1CC(=O)C1C MCULE-1068922218 [0,1,0,1,0,0|2,0,0]=4 5354 B7R1.21 CC1(CC1)CCBr MCULE-4700835198 [0,1,0,1,0,0|2,0,0]=4 5355 B7R1.21 CC1(CC1)CCN MCULE-1525421562 [0,1,0,1,0,0|2,0,0]=4 5356 B7R1.21 CC1(CC1)CCN MCULE-2587012619 [0,1,0,1,0,0|2,0,0]=4 5357 B7R1.21 CC1(CC1)CCO MCULE-4173763460 [0,1,0,1,0,0|1,0,0]=3 5358 B7R1.21 CCCC1(CC1)N MCULE-2015286161 [0,1,0,1,0,0|2,0,0]=4 5359 B7R1.21 CCCC1(CC1)N MCULE-9864007655 [0,1,0,1,0,0|2,0,0]=4 5360 B7R1.21 CCNC1(CC1)C MCULE-7289521608 [0,1,0,1,0,0|2,0,0]=4 5361 B7R1.21 CCNC1(CC1)C MCULE-7847765564 [0,1,0,1,0,0|2,0,0]=4 5362 B7R1.21 CCOC1(CC1)Br MCULE-7332246481 [0,1,0,1,0,0|1,0,0]=3 5363 B7R1.21 CCOC1(CC1)N MCULE-7603514903 [0,1,0,1,0,0|1,0,0]=3 5364 B7R1.21 CCOC1(CC1)O MCULE-9629273021 [0,1,0,1,0,0|1,0,0]=3 5365 B7R1.21 COCC1(CO1)C MCULE-8694642597 [0,1,0,1,0,0|2,0,0]=4 5366 B7R1.21 NC1(CC1)CCO MCULE-6023170197 [0,1,0,1,0,0|1,0,0]=3 5367 B7R1.21 NC1(CC1)CCO MCULE-6146864546 [0,1,0,1,0,0|1,0,0]=3 5368 B7R1.21 NCCC1(CC1)N MCULE-1950553965 [0,1,0,1,0,0|2,0,0]=4 5369 B7R1.21 NCCC1(CC1)N MCULE-4555905032 [0,1,0,1,0,0|2,0,0]=4 5370 B7R1.21 NCCC1(CC1)O MCULE-7254265215 [0,1,0,1,0,0|2,0,0]=4 5371 B7R1.21 NCCC1(CC1)O MCULE-9873887297 [0,1,0,1,0,0|2,0,0]=4 5372 B7R1.21 OC1(CC1)CCBr MCULE-4785989916 [0,1,0,1,0,0|2,0,0]=4 5373 B7R1.21 OCCC1(CC1)O MCULE-9575986419 [0,1,0,1,0,0|1,0,0]=3 5374 B7R1.22 C1(CO1)C(=O)OC MCULE-1350193594 [0,1,0,1,0,0|2,0,0]=4 5375 B7R1.22 CC(CBr)C1CC1 MCULE-6817011252 [0,1,0,1,0,0|2,0,0]=4 5376 B7R1.22 CC(CN)C1CC1 MCULE-8672047249 [0,1,0,1,0,0|2,0,0]=4 5377 B7R1.22 CC(CN)C1CC1 MCULE-9115092780 [0,1,0,1,0,0|2,0,0]=4 5378 B7R1.22 CC(CO)C1CC1 MCULE-8325587009 [0,1,0,1,0,0|1,0,0]=3 5379 B7R1.22 CCC(=O)C1CC1 MCULE-6231785303 [0,1,0,1,0,0|2,0,0]=4 5380 B7R1.22 CCC(N)C1CC1 MCULE-2935155085 [0,1,0,1,0,0|2,0,0]=4 5381 B7R1.22 CCC(N)C1CC1 MCULE-7295156418 [0,1,0,1,0,0|2,0,0]=4 5382 B7R1.22 CCC(O)C1CC1 MCULE-5753196768 [0,1,0,1,0,0|2,0,0]=4 5383 B7R1.22 CC[C@@H](N)C1CC1 MCULE-8184175332 [0,1,0,1,0,0|2,0,0]=4 5384 B7R1.22 CC[C@H](N)C1CC1 MCULE-5395953598 [0,1,0,1,0,0|2,0,0]=4 5385 B7R1.22 CC[C@H](N)C1CC1 MCULE-6843001585 [0,1,0,1,0,0|2,0,0]=4 5386 B7R1.22 CC[C@H](N)C1CC1 MCULE-8773009184 [0,1,0,1,0,0|2,0,0]=4 5387 B7R1.22 COC(=O)C1CO1 MCULE-1745412030 [0,1,0,1,0,0|2,0,0]=4 5388 B7R1.22 COC(=O)[C@@H]1CO1 MCULE-2259836812 [0,1,0,1,0,0|2,0,0]=4 5389 B7R1.22 COC(=O)[C@H]1CO1 MCULE-5568309714 [0,1,0,1,0,0|2,0,0]=4 5390 B7R1.22 COC(=O)[C@H]1CO1 MCULE-9432053348 [0,1,0,1,0,0|2,0,0]=4 5391 B7R1.22 ClCC(Cl)C1CO1 MCULE-4739045871 [0,1,0,1,0,0|2,0,0]=4 5392 B7R1.22 NC(CO)C1CC1 MCULE-5154854421 [0,1,0,1,0,0|1,0,0]=3 5393 B7R1.22 NC(CO)C1CC1 MCULE-8775546228 [0,1,0,1,0,0|1,0,0]=3 5394 B7R1.22 NCC(N)C1CC1 MCULE-9464810605 [0,1,0,1,0,0|2,0,0]=4 5395 B7R1.22 NCC(O)C1CC1 MCULE-4953920778 [0,1,0,1,0,0|2,0,0]=4 5396 B7R1.22 NCC(O)C1CC1 MCULE-5905916662 [0,1,0,1,0,0|2,0,0]=4 5397 B7R1.22 NC[C@@H](N)C1CC1 MCULE-3450570705 [0,1,0,1,0,0|2,0,0]=4 5398 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4753758413 [0,1,0,1,0,0|2,0,0]=4 5399 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4823446729 [0,1,0,1,0,0|2,0,0]=4 5400 B7R1.22 NC[C@@H](N)C1CC1 MCULE-7123860849 [0,1,0,1,0,0|2,0,0]=4 5401 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5231249344 [0,1,0,1,0,0|1,0,0]=3 5402 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5233980282 [0,1,0,1,0,0|1,0,0]=3 5403 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9664157108 [0,1,0,1,0,0|1,0,0]=3 5404 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9941605288 [0,1,0,1,0,0|1,0,0]=3 5405 B7R1.22 N[C@H](CO)C1CC1 MCULE-3523450080 [0,1,0,1,0,0|1,0,0]=3 5406 B7R1.22 N[C@H](CO)C1CC1 MCULE-6097147899 [0,1,0,1,0,0|1,0,0]=3 5407 B7R1.22 N[C@H](CO)C1CC1 MCULE-9050007019 [0,1,0,1,0,0|1,0,0]=3 5408 B7R1.22 N[C@H](CO)C1CC1 MCULE-9945100855 [0,1,0,1,0,0|1,0,0]=3 5409 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [0,1,0,1,0,0|1,0,1]=4 5410 B7R1.22 OC(CBr)C1CC1 MCULE-1163924206 [0,1,0,1,0,0|2,0,0]=4 5411 B7R1.22 OCC(O)C1CC1 MCULE-9694056700 [0,1,0,1,0,0|1,0,0]=3 5412 B7R1.22 [C@H]1(CO1)C(=O)OC MCULE-2114123664 [0,1,0,1,0,0|2,0,0]=4 5413 B7R1.25 CC1(CCC1)CBr MCULE-8887285694 [0,1,0,1,0,0|2,0,0]=4 5414 B7R1.25 CC1(CCC1)CN MCULE-2351992333 [0,1,0,1,0,0|2,0,0]=4 5415 B7R1.25 CC1(CCC1)CN MCULE-4768166684 [0,1,0,1,0,0|2,0,0]=4 5416 B7R1.25 CC1(CCC1)CO MCULE-9646690839 [0,1,0,1,0,0|1,0,0]=3 5417 B7R1.25 CC1(CCC1)CS MCULE-2920048402 [0,1,0,1,0,0|1,1,0]=4 5418 B7R1.25 CC1(CCN1)CO MCULE-2134260042 [0,1,0,1,0,0|1,0,0]=3 5419 B7R1.25 CC1(CCN1)CO MCULE-3210259937 [0,1,0,1,0,0|1,0,0]=3 5420 B7R1.25 CC1(CCO1)CN MCULE-1371408706 [0,1,0,1,0,0|1,0,0]=3 5421 B7R1.25 CC1(CCO1)CO MCULE-6424264752 [0,1,0,1,0,0|0,0,0]=2 5422 B7R1.25 CC1(CNC1)CO MCULE-4856424189 [0,1,0,1,0,0|2,0,0]=4 5423 B7R1.25 CC1(CNC1)CO MCULE-7118798664 [0,1,0,1,0,0|2,0,0]=4 5424 B7R1.25 CC1(COC1)CO MCULE-5859568263 [0,1,0,1,0,0|2,0,0]=4 5425 B7R1.25 CC1(CSC1)CO MCULE-2267957602 [0,1,0,1,0,0|2,0,0]=4 5426 B7R1.25 CCC1(CCC1)N MCULE-5053916607 [0,1,0,1,0,0|2,0,0]=4 5427 B7R1.25 CCC1(CCC1)N MCULE-5413278315 [0,1,0,1,0,0|2,0,0]=4 5428 B7R1.25 C[C@@]1(CCO1)CN MCULE-8755107224 [0,1,0,1,0,0|1,0,0]=3 5429 B7R1.25 C[C@@]1(CCO1)CO MCULE-4685471926 [0,1,0,1,0,0|0,0,0]=2 5430 B7R1.25 C[C@@]1(CCO1)CO MCULE-5799098537 [0,1,0,1,0,0|0,0,0]=2 5431 B7R1.25 C[C@]1(CCO1)CO MCULE-5749345841 [0,1,0,1,0,0|0,0,0]=2 5432 B7R1.25 FC1(CCC1)CBr MCULE-3319458488 [0,1,0,1,0,0|2,0,0]=4 5433 B7R1.25 NC1(CCC1)CF MCULE-1820863854 [0,1,0,1,0,0|2,0,0]=4 5434 B7R1.25 NC1(CCC1)CF MCULE-4073039809 [0,1,0,1,0,0|2,0,0]=4 5435 B7R1.25 NC1(CCC1)CO MCULE-3303213714 [0,1,0,1,0,0|1,0,0]=3 5436 B7R1.25 NC1(CCC1)CO MCULE-7230626576 [0,1,0,1,0,0|1,0,0]=3 5437 B7R1.25 NC1(COC1)CO MCULE-5347414182 [0,1,0,1,0,0|2,0,0]=4 5438 B7R1.25 NCC1(CCC1)F MCULE-4269584193 [0,1,0,1,0,0|2,0,0]=4 5439 B7R1.25 NCC1(CCC1)F MCULE-8050912377 [0,1,0,1,0,0|2,0,0]=4 5440 B7R1.25 NCC1(CCC1)N MCULE-4976713787 [0,1,0,1,0,0|2,0,0]=4 5441 B7R1.25 NCC1(CCC1)N MCULE-8019875303 [0,1,0,1,0,0|2,0,0]=4 5442 B7R1.25 NCC1(CCC1)O MCULE-1242555690 [0,1,0,1,0,0|2,0,0]=4 5443 B7R1.25 OC1(CCC1)CBr MCULE-7282991867 [0,1,0,1,0,0|2,0,0]=4 5444 B7R1.25 OCC1(CCC1)F MCULE-5944864184 [0,1,0,1,0,0|1,0,0]=3 5445 B7R1.25 OCC1(CCC1)O MCULE-2830358505 [0,1,0,1,0,0|1,0,0]=3 5446 B7R1.25 OCC1(CNC1)F MCULE-7526502512 [0,1,0,1,0,0|2,0,0]=4 5447 B7R1.25 OCC1(CNC1)F MCULE-7804174908 [0,1,0,1,0,0|2,0,0]=4 5448 B7R1.25 OCC1(CNC1)O MCULE-1089145184 [0,1,0,1,0,0|2,0,0]=4 5449 B7R1.25 OCC1(CNC1)O MCULE-8217738451 [0,1,0,1,0,0|2,0,0]=4 5450 B7R1.25 OCC1(CNC1)O MCULE-9215525935 [0,1,0,1,0,0|2,0,0]=4 5451 B7R1.25 OCC1(CNC1)O MCULE-9389454165 [0,1,0,1,0,0|2,0,0]=4 5452 B7R1.25 OCC1(COC1)F MCULE-9098723776 [0,1,0,1,0,0|2,0,0]=4 5453 B7R1.25 OCC1(COC1)O MCULE-4207928663 [0,1,0,1,0,0|2,0,0]=4 5454 B7R1.27 CC1(CC1Br)CO MCULE-5286402958 [0,1,0,1,0,0|2,0,0]=4 5455 B7R1.27 CC1(CC1F)CO MCULE-9626513813 [0,1,0,1,0,0|2,0,0]=4 5456 B7R1.27 CCC1(CC1N)C MCULE-2073505141 [0,1,0,1,0,0|2,0,0]=4 5457 B7R1.27 CCC1(CC1N)C MCULE-3927183672 [0,1,0,1,0,0|2,0,0]=4 5458 B7R1.7 BrCCCC1CC1 MCULE-1359115765 [0,1,0,1,0,0|2,0,0]=4 5459 B7R1.7 BrCCOC1CC1 MCULE-5137842235 [0,1,0,1,0,0|1,0,0]=3 5460 B7R1.7 C#CCCC1CO1 MCULE-8252140231 [0,1,0,1,0,0|1,0,1]=4 5461 B7R1.7 C=CCCC1CO1 MCULE-2331378134 [0,1,0,1,0,0|1,0,1]=4 5462 B7R1.7 C=CCC[C@H]1CO1 MCULE-4953904401 [0,1,0,1,0,0|1,0,1]=4 5463 B7R1.7 C=CCC[C@H]1CO1 MCULE-7730579466 [0,1,0,1,0,0|1,0,1]=4 5464 B7R1.7 CC/C=C/[C@H]1CO1 MCULE-2083815927 [0,1,0,1,0,0|1,0,0]=3 5465 B7R1.7 CCCCC1CO1 MCULE-8403189539 [0,1,0,1,0,0|1,0,0]=3 5466 B7R1.7 CCCNC1CC1 MCULE-7033521193 [0,1,0,1,0,0|2,0,0]=4 5467 B7R1.7 CCCNC1CC1 MCULE-8227176324 [0,1,0,1,0,0|2,0,0]=4 5468 B7R1.7 CCNCC1CC1 MCULE-3070053773 [0,1,0,1,0,0|2,0,0]=4 5469 B7R1.7 CCNCC1CC1 MCULE-5997221486 [0,1,0,1,0,0|2,0,0]=4 5470 B7R1.7 CCOCC1CO1 MCULE-2647353662 [0,1,0,1,0,0|0,0,0]=2 5471 B7R1.7 CCONC1CC1 MCULE-5199479207 [0,1,0,1,0,0|1,0,0]=3 5472 B7R1.7 CCONC1CC1 MCULE-5905564764 [0,1,0,1,0,0|1,0,0]=3 5473 B7R1.7 CNCCC1CC1 MCULE-2375777124 [0,1,0,1,0,0|2,0,0]=4 5474 B7R1.7 CNCCC1CC1 MCULE-9913761675 [0,1,0,1,0,0|2,0,0]=4 5475 B7R1.7 CNOCC1CC1 MCULE-1735426846 [0,1,0,1,0,0|2,0,0]=4 5476 B7R1.7 CNOCC1CC1 MCULE-3664885073 [0,1,0,1,0,0|2,0,0]=4 5477 B7R1.7 COCCC1CO1 MCULE-9068008411 [0,1,0,1,0,0|1,0,0]=3 5478 B7R1.7 COCNC1CC1 MCULE-6233934333 [0,1,0,1,0,0|2,0,0]=4 5479 B7R1.7 ClCCOC1CC1 MCULE-1732267732 [0,1,0,1,0,0|1,0,0]=3 5480 B7R1.7 N#CCCC1CC1 MCULE-2020373635 [0,1,0,1,0,0|2,0,0]=4 5481 B7R1.7 NCCCC1CC1 MCULE-1579218471 [0,1,0,1,0,0|2,0,0]=4 5482 B7R1.7 NCCCC1CC1 MCULE-8160460213 [0,1,0,1,0,0|2,0,0]=4 5483 B7R1.7 NCCNC1CC1 MCULE-9756738460 [0,1,0,1,0,0|2,0,0]=4 5484 B7R1.7 NCCOC1CC1 MCULE-2021686793 [0,1,0,1,0,0|1,0,0]=3 5485 B7R1.7 NCCOC1CC1 MCULE-9123639402 [0,1,0,1,0,0|1,0,0]=3 5486 B7R1.7 NOCCC1CC1 MCULE-1304023980 [0,1,0,1,0,0|1,0,0]=3 5487 B7R1.7 NOCCC1CC1 MCULE-8656049274 [0,1,0,1,0,0|1,0,0]=3 5488 B7R1.7 O=CCCC1CC1 MCULE-2890512932 [0,1,0,1,0,0|1,0,1]=4 5489 B7R1.7 OCC#CC1CC1 MCULE-2880378177 [0,1,0,1,0,0|1,0,1]=4 5490 B7R1.7 OCC=CC1CC1 MCULE-8179220972 [0,1,0,1,0,0|1,0,1]=4 5491 B7R1.7 OCCCC1CC1 MCULE-5336501479 [0,1,0,1,0,0|1,0,0]=3 5492 B7R1.7 OCCNC1CC1 MCULE-2068668434 [0,1,0,1,0,0|1,0,0]=3 5493 B7R1.7 OCCOC1CC1 MCULE-8583841482 [0,1,0,1,0,0|0,0,0]=2 5494 B7R1.7 ON=CCC1CC1 MCULE-4604594732 [0,1,0,1,0,0|1,0,1]=4 5495 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-1713655941 [0,1,0,1,0,0|2,0,0]=4 5496 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-5926317826 [0,1,0,1,0,0|2,0,0]=4 5497 B7R1.12 CC1CC1C(=O)O MCULE-1757330006 [0,1,0,1,0,0|1,0,1]=4 5498 B7R1.12 C[C@@H]1C[C@@H]1B(O)O MCULE-4091409950 [0,1,0,1,0,0|2,0,0]=4 5499 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-1245851874 [0,1,0,1,0,0|1,0,1]=4 5500 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-9582782871 [0,1,0,1,0,0|1,0,1]=4 5501 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-2621918749 [0,1,0,1,0,0|1,0,1]=4 5502 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-7347988261 [0,1,0,1,0,0|1,0,1]=4 5503 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-4499487863 [0,1,0,1,0,0|1,0,1]=4 5504 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-9300153165 [0,1,0,1,0,0|1,0,1]=4 5505 B7R1.12 C[C@H]1C[C@H]1B(O)O MCULE-9584013970 [0,1,0,1,0,0|2,0,0]=4 5506 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-4410115478 [0,1,0,1,0,0|1,0,1]=4 5507 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-6590525761 [0,1,0,1,0,0|1,0,1]=4 5508 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-8070492716 [0,1,0,1,0,0|1,0,1]=4 5509 B7R1.12 [C@H]1(C[C@H]1C(=O)O)C MCULE-9539625763 [0,1,0,1,0,0|1,0,1]=4 5510 B7R1.14 CC1(CCCC1)Br MCULE-8706490914 [0,1,0,1,0,0|2,0,0]=4 5511 B7R1.14 CC1(CCCC1)N MCULE-1696024032 [0,1,0,1,0,0|2,0,0]=4 5512 B7R1.14 CC1(CCCC1)N MCULE-7897960444 [0,1,0,1,0,0|2,0,0]=4 5513 B7R1.14 CC1(CCCC1)O MCULE-1425529053 [0,1,0,1,0,0|1,0,0]=3 5514 B7R1.14 CC1(CCCN1)C MCULE-3172250386 [0,1,0,1,0,0|2,0,0]=4 5515 B7R1.14 CC1(CCCN1)C MCULE-6227706175 [0,1,0,1,0,0|2,0,0]=4 5516 B7R1.14 CC1(CCNC1)C MCULE-3460660754 [0,1,0,1,0,0|2,0,0]=4 5517 B7R1.14 CC1(CCNC1)C MCULE-7874744806 [0,1,0,1,0,0|2,0,0]=4 5518 B7R1.14 CC1(CCNC1)C MCULE-9717378283 [0,1,0,1,0,0|2,0,0]=4 5519 B7R1.14 CC1(CCNC1)F MCULE-1205333206 [0,1,0,1,0,0|2,0,0]=4 5520 B7R1.14 CC1(CCNC1)F MCULE-8512729081 [0,1,0,1,0,0|2,0,0]=4 5521 B7R1.14 CC1(CCNC1)N MCULE-9317786482 [0,1,0,1,0,0|2,0,0]=4 5522 B7R1.14 CC1(CCNC1)N MCULE-9638120938 [0,1,0,1,0,0|2,0,0]=4 5523 B7R1.14 CC1(CCNC1)O MCULE-1812572207 [0,1,0,1,0,0|1,0,0]=3 5524 B7R1.14 CC1(CCNC1)O MCULE-3978790995 [0,1,0,1,0,0|1,0,0]=3 5525 B7R1.14 CC1(CCNC1)O MCULE-6355817754 [0,1,0,1,0,0|1,0,0]=3 5526 B7R1.14 CC1(CCNC1)O MCULE-7199660654 [0,1,0,1,0,0|1,0,0]=3 5527 B7R1.14 CC1(CCOC1)N MCULE-1997756007 [0,1,0,1,0,0|1,0,0]=3 5528 B7R1.14 CC1(CCOC1)N MCULE-5807249895 [0,1,0,1,0,0|1,0,0]=3 5529 B7R1.14 CC1(CCOC1)O MCULE-5065022086 [0,1,0,1,0,0|0,0,0]=2 5530 B7R1.14 CC1(CCSC1)O MCULE-3138867143 [0,1,0,1,0,0|0,1,0]=3 5531 B7R1.14 CC1(COCN1)C MCULE-4655412355 [0,1,0,1,0,0|2,0,0]=4 5532 B7R1.14 CC1(NCCO1)C MCULE-5384206883 [0,1,0,1,0,0|1,0,0]=3 5533 B7R1.14 CC1(NCCS1)C MCULE-6270583158 [0,1,0,1,0,0|1,1,0]=4 5534 B7R1.14 CC1(OCCO1)C MCULE-3382136459 [0,1,0,1,0,0|0,0,0]=2 5535 B7R1.14 C[C@@]1(CCNC1)F MCULE-1340440767 [0,1,0,1,0,0|2,0,0]=4 5536 B7R1.14 C[C@@]1(CCNC1)F MCULE-5898059594 [0,1,0,1,0,0|2,0,0]=4 5537 B7R1.14 C[C@@]1(CCNC1)F MCULE-6901424312 [0,1,0,1,0,0|2,0,0]=4 5538 B7R1.14 C[C@@]1(CCNC1)F MCULE-9433824470 [0,1,0,1,0,0|2,0,0]=4 5539 B7R1.14 C[C@@]1(CCNC1)N MCULE-3652011553 [0,1,0,1,0,0|2,0,0]=4 5540 B7R1.14 C[C@@]1(CCNC1)O MCULE-2185266890 [0,1,0,1,0,0|1,0,0]=3 5541 B7R1.14 C[C@@]1(CCNC1)O MCULE-4472850857 [0,1,0,1,0,0|1,0,0]=3 5542 B7R1.14 C[C@@]1(CCNC1)O MCULE-7216590589 [0,1,0,1,0,0|1,0,0]=3 5543 B7R1.14 C[C@@]1(CCNC1)O MCULE-9031112405 [0,1,0,1,0,0|1,0,0]=3 5544 B7R1.14 C[C@@]1(CNOC1)O MCULE-2135476163 [0,1,0,1,0,0|1,0,0]=3 5545 B7R1.14 C[C@@]1(CNOC1)O MCULE-2596956621 [0,1,0,1,0,0|1,0,0]=3 5546 B7R1.14 C[C@@]1(CNOC1)O MCULE-6080745149 [0,1,0,1,0,0|1,0,0]=3 5547 B7R1.14 C[C@@]1(CNOC1)O MCULE-7091595110 [0,1,0,1,0,0|1,0,0]=3 5548 B7R1.14 C[C@]1(CCNC1)F MCULE-1291336282 [0,1,0,1,0,0|2,0,0]=4 5549 B7R1.14 C[C@]1(CCNC1)F MCULE-2571688853 [0,1,0,1,0,0|2,0,0]=4 5550 B7R1.14 C[C@]1(CCNC1)O MCULE-2513078981 [0,1,0,1,0,0|1,0,0]=3 5551 B7R1.14 C[C@]1(CCNC1)O MCULE-2837064957 [0,1,0,1,0,0|1,0,0]=3 5552 B7R1.14 C[C@]1(CCNC1)O MCULE-5133863014 [0,1,0,1,0,0|1,0,0]=3 5553 B7R1.14 C[C@]1(CCNC1)O MCULE-5887726834 [0,1,0,1,0,0|1,0,0]=3 5554 B7R1.14 C[C@]1(CNOC1)O MCULE-1405004782 [0,1,0,1,0,0|1,0,0]=3 5555 B7R1.14 C[C@]1(CNOC1)O MCULE-4558122242 [0,1,0,1,0,0|1,0,0]=3 5556 B7R1.14 FC1(CCNC1)F MCULE-9262317649 [0,1,0,1,0,0|2,0,0]=4 5557 B7R1.14 FC1(CC[NH2+]C1)F MCULE-5155002822 [0,1,0,1,0,0|2,0,0]=4 5558 B7R1.14 FC1(CNOC1)F MCULE-3109048059 [0,1,0,1,0,0|2,0,0]=4 5559 B7R1.14 FC1(CNOC1)F MCULE-9610114974 [0,1,0,1,0,0|2,0,0]=4 5560 B7R1.14 O=P1(OCCO1)Cl MCULE-8220157277 [0,1,0,1,0,0|2,0,0]=4 5561 B7R1.14 O=S1(=O)OCCO1 MCULE-4563579294 [0,1,0,1,0,0|2,0,0]=4 5562 B7R1.17 CC1(CCC1Br)C MCULE-2707590334 [0,1,0,1,0,0|2,0,0]=4 5563 B7R1.17 CC1(CCC1N)C MCULE-3143969489 [0,1,0,1,0,0|2,0,0]=4 5564 B7R1.17 CC1(CCC1N)C MCULE-7719131610 [0,1,0,1,0,0|2,0,0]=4 5565 B7R1.17 CC1(CCC1O)C MCULE-7385359414 [0,1,0,1,0,0|1,0,0]=3 5566 B7R1.17 CC1(CC[C@@H]1O)C MCULE-9766955692 [0,1,0,1,0,0|1,0,0]=3 5567 B7R1.17 CC1(NCC1O)C MCULE-5840741801 [0,1,0,1,0,0|1,0,0]=3 5568 B7R1.17 CC1(NCC1O)C MCULE-7044413523 [0,1,0,1,0,0|1,0,0]=3 5569 B7R1.17 CC1(OCC1=O)C MCULE-5758313494 [0,1,0,1,0,0|0,0,2]=4 5570 B7R1.17 CC1(OCC1N)C MCULE-2792085100 [0,1,0,1,0,0|1,0,0]=3 5571 B7R1.17 CC1(OCC1O)C MCULE-4679216060 [0,1,0,1,0,0|0,0,0]=2 5572 B7R1.17 CC1(OC[C@@H]1N)C MCULE-1806722832 [0,1,0,1,0,0|1,0,0]=3 5573 B7R1.17 CC1(SCC1N)C MCULE-2967285527 [0,1,0,1,0,0|1,1,0]=4 5574 B7R1.17 CC1(SCC1N)C MCULE-3093982180 [0,1,0,1,0,0|1,1,0]=4 5575 B7R1.17 CC1NCC1(F)F MCULE-1956414038 [0,1,0,1,0,0|2,0,0]=4 5576 B7R1.17 CC1NCC1(F)F MCULE-1970006339 [0,1,0,1,0,0|2,0,0]=4 5577 B7R1.17 C[C@@H]1NCC1(F)F MCULE-5175218628 [0,1,0,1,0,0|2,0,0]=4 5578 B7R1.17 C[C@@H]1NCC1(F)F MCULE-7899231967 [0,1,0,1,0,0|2,0,0]=4 5579 B7R1.17 C[C@@H]1NCC1(F)F MCULE-9534584245 [0,1,0,1,0,0|2,0,0]=4 5580 B7R1.17 C[C@@H]1NCC1(F)F MCULE-9843997255 [0,1,0,1,0,0|2,0,0]=4 5581 B7R1.17 C[C@H]1NCC1(F)F MCULE-1873777384 [0,1,0,1,0,0|2,0,0]=4 5582 B7R1.17 C[C@H]1NCC1(F)F MCULE-6528763696 [0,1,0,1,0,0|2,0,0]=4 5583 B7R1.17 C[C@H]1NCC1(F)F MCULE-8252201644 [0,1,0,1,0,0|2,0,0]=4 5584 B7R1.17 C[C@H]1NCC1(F)F MCULE-9118002562 [0,1,0,1,0,0|2,0,0]=4 5585 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [0,1,0,1,0,0|1,0,1]=4 5586 B7R1.18 CC(N)C1CCC1 MCULE-1055775237 [0,1,0,1,0,0|2,0,0]=4 5587 B7R1.18 CC(N)C1CCC1 MCULE-4303681430 [0,1,0,1,0,0|2,0,0]=4 5588 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [0,1,0,1,0,0|1,0,0]=3 5589 B7R1.18 CC(O)C1CNC1 MCULE-1265886795 [0,1,0,1,0,0|2,0,0]=4 5590 B7R1.18 CC(O)C1CNC1 MCULE-5108259269 [0,1,0,1,0,0|2,0,0]=4 5591 B7R1.18 CC(O)C1CNC1 MCULE-8265279011 [0,1,0,1,0,0|2,0,0]=4 5592 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [0,1,0,1,0,0|2,0,0]=4 5593 B7R1.18 C[C@@H](N)C1CCC1 MCULE-4670161237 [0,1,0,1,0,0|2,0,0]=4 5594 B7R1.18 C[C@@H](N)C1CCC1 MCULE-6520272933 [0,1,0,1,0,0|2,0,0]=4 5595 B7R1.18 C[C@@H](N)C1CCC1 MCULE-8342688572 [0,1,0,1,0,0|2,0,0]=4 5596 B7R1.18 C[C@@H](N)C1CCC1 MCULE-9076983662 [0,1,0,1,0,0|2,0,0]=4 5597 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [0,1,0,1,0,0|1,0,0]=3 5598 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [0,1,0,1,0,0|2,0,0]=4 5599 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [0,1,0,1,0,0|2,0,0]=4 5600 B7R1.18 C[C@H](N)C1CCC1 MCULE-2555280675 [0,1,0,1,0,0|2,0,0]=4 5601 B7R1.18 C[C@H](N)C1CCC1 MCULE-3888125434 [0,1,0,1,0,0|2,0,0]=4 5602 B7R1.18 C[C@H](N)C1CCC1 MCULE-6963105805 [0,1,0,1,0,0|2,0,0]=4 5603 B7R1.18 C[C@H](N)C1CCC1 MCULE-7483270694 [0,1,0,1,0,0|2,0,0]=4 5604 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [0,1,0,1,0,0|1,0,0]=3 5605 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [0,1,0,1,0,0|1,0,0]=3 5606 B7R1.18 C[C@H](O)C1CNC1 MCULE-4694154501 [0,1,0,1,0,0|2,0,0]=4 5607 B7R1.18 C[C@H](O)C1CNC1 MCULE-5870270724 [0,1,0,1,0,0|2,0,0]=4 5608 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [0,1,0,1,0,0|2,0,0]=4 5609 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [0,1,0,1,0,0|2,0,0]=4 5610 B7R1.18 FC(F)C1CCN1 MCULE-3910207881 [0,1,0,1,0,0|2,0,0]=4 5611 B7R1.18 FC(F)C1CCN1 MCULE-5707260715 [0,1,0,1,0,0|2,0,0]=4 5612 B7R1.18 FC(F)[C@@H]1CCN1 MCULE-1910962420 [0,1,0,1,0,0|2,0,0]=4 5613 B7R1.18 FC(F)[C@@H]1CCN1 MCULE-6835685852 [0,1,0,1,0,0|2,0,0]=4 5614 B7R1.18 FC(F)[C@H]1CCN1 MCULE-1770896469 [0,1,0,1,0,0|2,0,0]=4 5615 B7R1.18 FC(F)[C@H]1CCN1 MCULE-5057191247 [0,1,0,1,0,0|2,0,0]=4 5616 B7R1.18 FC(F)[C@H]1CCN1 MCULE-7880065029 [0,1,0,1,0,0|2,0,0]=4 5617 B7R1.18 FC(F)[C@H]1CCN1 MCULE-8422110066 [0,1,0,1,0,0|2,0,0]=4 5618 B7R1.18 O=C(O)C1CCC1 MCULE-2498509888 [0,1,0,1,0,0|1,0,1]=4 5619 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [0,1,0,1,0,0|1,0,1]=4 5620 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [0,1,0,1,0,0|1,0,1]=4 5621 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [0,1,0,1,0,0|1,0,1]=4 5622 B7R1.18 O=C(O)C1CCO1 MCULE-6065911736 [0,1,0,1,0,0|0,0,1]=3 5623 B7R1.18 O=C(O)C1CCO1 MCULE-9296370119 [0,1,0,1,0,0|0,0,1]=3 5624 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [0,1,0,1,0,0|1,0,1]=4 5625 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [0,1,0,1,0,0|1,0,1]=4 5626 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [0,1,0,1,0,0|1,0,1]=4 5627 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [0,1,0,1,0,0|1,0,1]=4 5628 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-5117442811 [0,1,0,1,0,0|0,0,1]=3 5629 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-8116248615 [0,1,0,1,0,0|0,0,1]=3 5630 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [0,1,0,1,0,0|1,0,1]=4 5631 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [0,1,0,1,0,0|1,0,1]=4 5632 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [0,1,0,1,0,0|1,0,1]=4 5633 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [0,1,0,1,0,0|1,0,1]=4 5634 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-5499247834 [0,1,0,1,0,0|0,0,1]=3 5635 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-7468207073 [0,1,0,1,0,0|0,0,1]=3 5636 B7R1.18 OB(O)C1CCC1 MCULE-3574521261 [0,1,0,1,0,0|2,0,0]=4 5637 B7R1.20 CC(C)CC1CO1 MCULE-7259971470 [0,1,0,1,0,0|1,0,0]=3 5638 B7R1.20 CC(C)NC1CC1 MCULE-6011790113 [0,1,0,1,0,0|2,0,0]=4 5639 B7R1.20 CC(C)NC1CC1 MCULE-8727654998 [0,1,0,1,0,0|2,0,0]=4 5640 B7R1.20 CC(N)CC1CC1 MCULE-1913565015 [0,1,0,1,0,0|2,0,0]=4 5641 B7R1.20 CC(N)CC1CC1 MCULE-2214997571 [0,1,0,1,0,0|2,0,0]=4 5642 B7R1.20 CC(O)CC1CC1 MCULE-1952195648 [0,1,0,1,0,0|1,0,0]=3 5643 B7R1.20 CN(C)CC1CO1 MCULE-3116266625 [0,1,0,1,0,0|2,0,0]=4 5644 B7R1.20 C[C@@H](O)CC1CC1 MCULE-2616688976 [0,1,0,1,0,0|1,0,0]=3 5645 B7R1.20 C[C@H](O)CC1CC1 MCULE-5001414363 [0,1,0,1,0,0|1,0,0]=3 5646 B7R1.20 O=C(O)CC1CC1 MCULE-3026300598 [0,1,0,1,0,0|1,0,1]=4 5647 B7R1.20 OB(O)CC1CC1 MCULE-2775080556 [0,1,0,1,0,0|2,0,0]=4 5648 B7R1.23 CC1(CC1CN)C MCULE-5243006209 [0,1,0,1,0,0|2,0,0]=4 5649 B7R1.23 CC1(CC1CN)C MCULE-8803769775 [0,1,0,1,0,0|2,0,0]=4 5650 B7R1.23 CC1(CC1CO)Br MCULE-1246890004 [0,1,0,1,0,0|1,0,0]=3 5651 B7R1.23 CC1(CC1CO)C MCULE-3855230422 [0,1,0,1,0,0|1,0,0]=3 5652 B7R1.23 CC1(C[C@@H]1CO)C MCULE-2771980454 [0,1,0,1,0,0|1,0,0]=3 5653 B7R1.23 CC1(C[C@H]1CO)C MCULE-7876524457 [0,1,0,1,0,0|1,0,0]=3 5654 B7R1.23 CC1(OC1CBr)C MCULE-1797899499 [0,1,0,1,0,0|1,0,0]=3 5655 B7R1.23 CC1(OC1CCl)C MCULE-6494110934 [0,1,0,1,0,0|1,0,0]=3 5656 B7R1.23 CC1(OC1CO)C MCULE-5147602353 [0,1,0,1,0,0|0,0,0]=2 5657 B7R1.23 OCC1CC1(Br)Br MCULE-7089012177 [0,1,0,1,0,0|2,0,0]=4 5658 B7R1.23 OCC1CC1(Cl)Cl MCULE-7270696266 [0,1,0,1,0,0|2,0,0]=4 5659 B7R1.23 OCC1CC1(F)F MCULE-7947011827 [0,1,0,1,0,0|2,0,0]=4 5660 B7R1.23 OCC1CC1(F)F MCULE-8758794887 [0,1,0,1,0,0|2,0,0]=4 5661 B7R1.23 OC[C@@H]1CC1(F)F MCULE-7341169417 [0,1,0,1,0,0|2,0,0]=4 5662 B7R1.23 OC[C@@H]1CC1(F)F MCULE-8085476948 [0,1,0,1,0,0|2,0,0]=4 5663 B7R1.23 OC[C@H]1CC1(F)F MCULE-4517768682 [0,1,0,1,0,0|2,0,0]=4 5664 B7R1.23 OC[C@H]1CC1(F)F MCULE-7100712334 [0,1,0,1,0,0|2,0,0]=4 5665 B7R1.24 C1=CCCCCC1 MCULE-4514853156 [0,1,0,1,0,0|2,0,0]=4 5666 B7R1.24 C1=CCCNCC1 MCULE-4540835407 [0,1,0,1,0,0|2,0,0]=4 5667 B7R1.24 C1=CCCNCC1 MCULE-9349712539 [0,1,0,1,0,0|2,0,0]=4 5668 B7R1.24 C1=CCOCOC1 MCULE-2815492798 [0,1,0,1,0,0|1,0,1]=4 5669 B7R1.24 C1CCCCCC1 MCULE-5257270866 [0,1,0,1,0,0|2,0,0]=4 5670 B7R1.24 C1CCCNCC1 MCULE-6467465155 [0,1,0,1,0,0|2,0,0]=4 5671 B7R1.24 C1CCCOCC1 MCULE-9994899395 [0,1,0,1,0,0|1,0,0]=3 5672 B7R1.24 C1CCNCNC1 MCULE-9023922794 [0,1,0,1,0,0|2,0,0]=4 5673 B7R1.24 C1CCNNCC1 MCULE-1174944539 [0,1,0,1,0,0|2,0,0]=4 5674 B7R1.24 C1CCNNCC1 MCULE-8518491960 [0,1,0,1,0,0|2,0,0]=4 5675 B7R1.24 C1CCNOCC1 MCULE-7242354366 [0,1,0,1,0,0|1,0,0]=3 5676 B7R1.24 C1CCNOCC1 MCULE-7451936178 [0,1,0,1,0,0|1,0,0]=3 5677 B7R1.24 C1CCOCOC1 MCULE-4779745094 [0,1,0,1,0,0|1,0,0]=3 5678 B7R1.24 C1CNCCNC1 MCULE-8878366291 [0,1,0,1,0,0|2,0,0]=4 5679 B7R1.24 C1CNCCOC1 MCULE-9147617519 [0,1,0,1,0,0|1,0,0]=3 5680 B7R1.24 C1CNCCOC1 MCULE-9722986943 [0,1,0,1,0,0|1,0,0]=3 5681 B7R1.24 C1CNCCSC1 MCULE-3091366568 [0,1,0,1,0,0|1,1,0]=4 5682 B7R1.24 C1CNCCSC1 MCULE-7881506212 [0,1,0,1,0,0|1,1,0]=4 5683 B7R1.24 C1CNNCCN1 MCULE-5761778560 [0,1,0,1,0,0|2,0,0]=4 5684 B7R1.24 C1CNOCCN1 MCULE-3548078740 [0,1,0,1,0,0|1,0,0]=3 5685 B7R1.24 C1CNOCCN1 MCULE-4676245477 [0,1,0,1,0,0|1,0,0]=3 5686 B7R1.24 C1COCCNN1 MCULE-5237837037 [0,1,0,1,0,0|1,0,0]=3 5687 B7R1.24 C1COCCNN1 MCULE-6195400312 [0,1,0,1,0,0|1,0,0]=3 5688 B7R1.24 C1COCCNN1 MCULE-8018224954 [0,1,0,1,0,0|1,0,0]=3 5689 B7R1.24 C1COCCON1 MCULE-1064422282 [0,1,0,1,0,0|0,0,0]=2 5690 B7R1.24 C1COCCON1 MCULE-2039128953 [0,1,0,1,0,0|0,0,0]=2 5691 B7R1.24 C1CSSCCN1 MCULE-1533838386 [0,1,0,1,0,0|1,1,0]=4 5692 B7R2.13 C1=CC2OC2C1 MCULE-9601635666 [0,0,0,2,0,0|1,0,1]=4 5693 B7R2.13 C1CC2CC2C1 MCULE-4998824123 [0,0,0,2,0,0|2,0,0]=4 5694 B7R2.13 C1CC2CC2N1 MCULE-5625544754 [0,0,0,2,0,0|2,0,0]=4 5695 B7R2.13 C1CC2CC2N1 MCULE-6822939101 [0,0,0,2,0,0|2,0,0]=4 5696 B7R2.13 C1CC2NC2C1 MCULE-4807869634 [0,0,0,2,0,0|2,0,0]=4 5697 B7R2.13 C1CC2OC2C1 MCULE-9831160642 [0,0,0,2,0,0|1,0,0]=3 5698 B7R2.13 C1NCC2C1C2 MCULE-5688427614 [0,0,0,2,0,0|2,0,0]=4 5699 B7R2.13 C1NCC2C1C2 MCULE-7833686848 [0,0,0,2,0,0|2,0,0]=4 5700 B7R2.13 C1NCC2C1O2 MCULE-2427865207 [0,0,0,2,0,0|1,0,0]=3 5701 B7R2.13 C1NCC2C1O2 MCULE-9737269595 [0,0,0,2,0,0|1,0,0]=3 5702 B7R2.13 C1NC[C@H]2[C@@H]1C2 MCULE-2763696860 [0,0,0,2,0,0|2,0,0]=4 5703 B7R2.13 C1OCC2C1O2 MCULE-5569274990 [0,0,0,2,0,0|0,0,0]=2 5704 B7R2.11 C1CC2CC1N2 MCULE-6529016485 [0,0,0,2,0,0|2,0,0]=4 5705 B7R2.11 C1CC2CC1N2 MCULE-7997985442 [0,0,0,2,0,0|2,0,0]=4 5706 B7R2.11 C1NC2CC1C2 MCULE-3826765557 [0,0,0,2,0,0|2,0,0]=4 5707 B7R2.11 C1NC2CC1C2 MCULE-4168683722 [0,0,0,2,0,0|2,0,0]=4 5708 B7R2.1 C1CC1C2CO2 MCULE-9859676878 [0,0,0,2,0,0|1,0,0]=3 5709 B7R2.1 C1O[C@@H]1[C@@H]2CO2 MCULE-3158496673 [0,0,0,2,0,0|2,0,0]=4 5710 B7R2.1 C1O[C@@H]1[C@@H]2CO2 MCULE-4139336692 [0,0,0,2,0,0|2,0,0]=4 5711 B7R2.3 BrC1CC12CC2 MCULE-6919212225 [0,0,0,2,0,0|2,0,0]=4 5712 B7R2.3 NC1CC12CC2 MCULE-4664631556 [0,0,0,2,0,0|2,0,0]=4 5713 B7R2.3 NC1CC12CC2 MCULE-7886006711 [0,0,0,2,0,0|2,0,0]=4 5714 B7R2.16 C1CC2(C1)CO2 MCULE-6375096145 [0,0,0,2,0,0|1,0,0]=3 5715 B7R2.16 C1CC2(N1)CC2 MCULE-7587259458 [0,0,0,2,0,0|2,0,0]=4 5716 B7R2.16 C1CC2(N1)CC2 MCULE-8557810491 [0,0,0,2,0,0|2,0,0]=4 5717 B7R2.16 C1OCC12CO2 MCULE-4629544610 [0,0,0,2,0,0|2,0,0]=4